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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Found 42 results

Search term: C21H18O13 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4438874

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1
C21H18O13478.3598537800
18699310

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21?/m0/s1
C21H18O13478.3598205501
9816222

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-8-2-1-6(3-9(8)23)18-15(27)13(25)12-10(24)4-7(5-11(12)33-18)32-21-17(29)14(26)16(28)19(34-21)20(30)31/h1-5,14,16-17,19,21-24,26-29H,(H,30,31)/t14-,16-,17+,19-,21+/m0/s1
C21H18O13478.3598202000
9830649

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-4-9(24)12-11(5-7)32-18(15(27)13(12)25)6-1-2-8(23)10(3-6)33-21-17(29)14(26)16(28)19(34-21)20(30)31/h1-5,14,16-17,19,21-24,26-29H,(H,30,31)/t14-,16-,17+,19-,21+/m0/s1
C21H18O13478.3598161500
398346

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H18O13/c22-10-1-8(2-11(23)16(10)26)20(31)33-14-5-7(19(29)30)6-15(18(14)28)34-21(32)9-3-12(24)17(27)13(25)4-9/h1-5,14-15,18,22-28H,6H2,(H,29,30)/t14-,15-,18-/m1/s1
C21H18O13478.3598151300
405514

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H18O13/c22-10-2-8(3-11(23)16(10)27)20(31)33-15-6-7(19(29)30)1-14(26)18(15)34-21(32)9-4-12(24)17(28)13(25)5-9/h1-5,14-15,18,22-28H,6H2,(H,29,30)/t14-,15-,18-/m1/s1
C21H18O13478.359810900
9400395

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c1-30-16-7(23)2-5-11-10-6(20(29)34-18(11)16)3-8(13(25)17(10)33-19(5)28)31-21-15(27)14(26)12(24)9(4-22)32-21/h2-3,9,12,14-15,21-27H,4H2,1H3/t9-,12-,14+,15-,21-/m1/s1
C21H18O13478.35988800
417245

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H18O13/c22-10-2-8(3-11(23)16(10)26)20(31)34-15-6-9(4-13(25)18(15)28)21(32)33-14-5-7(19(29)30)1-12(24)17(14)27/h1-4,6,12,14,17,22-28H,5H2,(H,29,30)/t12-,14-,17-/m1/s1
C21H18O13478.35987700
30777025

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-4-9(24)12-11(5-7)32-18(15(27)13(12)25)6-1-2-10(8(23)3-6)33-21-17(29)14(26)16(28)19(34-21)20(30)31/h1-5,14,16-17,19,21-24,26-29H,(H,30,31)/t14-,16-,17+,19-,21+/m0/s1
C21H18O13478.35987700
32674249

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m1/s1
C21H18O13478.35984300
10176995

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)
C21H18O13478.35984500
24844949

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-4-9(24)12-11(5-7)32-18(15(27)13(12)25)6-1-2-10(8(23)3-6)33-21-17(29)14(26)16(28)19(34-21)20(30)31/h1-5,14,16-17,19,21-24,26-29H,(H,30,31)/t14?,16-,17?,19-,21+/m0/s1
C21H18O13478.35983300
23339723

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-2-1-6(3-8(7)23)12-5-10(25)13-9(24)4-11(26)17(18(13)32-12)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-24,26-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1
C21H18O13478.35983300
24844103

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-2-1-6(3-8(7)23)11-4-9(24)13-12(32-11)5-10(25)18(14(13)26)33-21-17(29)15(27)16(28)19(34-21)20(30)31/h1-5,15-17,19,21-23,25-29H,(H,30,31)/t15-,16-,17?,19?,21+/m0/s1
C21H18O13478.35982200
24844109

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-2-1-6(3-8(7)23)10-4-9(24)13-11(32-10)5-12(14(25)15(13)26)33-21-18(29)16(27)17(28)19(34-21)20(30)31/h1-5,16-19,21-23,25-29H,(H,30,31)/t16-,17-,18?,19?,21+/m0/s1
C21H18O13478.35982200
24844233

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-2-1-6(3-8(7)23)12-5-10(25)13-9(24)4-11(26)17(18(13)32-12)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-24,26-29H,(H,30,31)/t14-,15-,16?,19?,21+/m0/s1
C21H18O13478.35982200
24844895

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14?,15-,16?,19+,21-/m1/s1
C21H18O13478.35982200
24845666

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H18O13/c22-7-3-1-6(2-4-7)16-13(27)11(25)10-8(23)5-9(24)17(18(10)32-16)33-21-15(29)12(26)14(28)19(34-21)20(30)31/h1-5,12,14-15,19,21-24,26-29H,(H,30,31)/t12-,14-,15?,19?,21+/m0/s1
C21H18O13478.35982200
10145816

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16-,19+,21-/m1/s1
C21H18O13478.35982200
82965805

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21?/m1/s1
C21H18O13478.35982100
123

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