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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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Single/Multi-component
Isotopically Labeled
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Found 725 results

Search term: C18H22O5 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444897


Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1
C18H22O5318.3643105229132164
251286

InChI=1/C18H22O5/c1-19-15-7-5-13(9-17(15)21-3)11-23-12-14-6-8-16(20-2)18(10-14)22-4/h5-10H,11-12H2,1-4H3
C18H22O5318.3643634000
316689
InChI=1/C18H22O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
C18H22O5318.3643595000
546394
InChI=1/C18H22O5/c1-19-15-3-7-17(8-4-15)22-13-11-21-12-14-23-18-9-5-16(20-2)6-10-18/h3-10H,11-14H2,1-2H3
C18H22O5318.3643533700
2040920
InChI=1/C18H22O5/c1-2-4-16-14-18-17(13-15(16)3-1)22-11-9-20-7-5-19-6-8-21-10-12-23-18/h1-4,13-14H,5-12H2
C18H22O5318.36428524100
23077814
InChI=1/C18H22O5/c1-6-23-18(20)11-7-13-12(14(19)8-11)9-15(21-4)17(22-5)16(13)10(2)3/h7-10,19H,6H2,1-5H3
C18H22O5318.3643412500
20202833
InChI=1/C18H22O5/c1-3-4-5-6-7-15-12(2)14-9-8-13(22-11-17(19)20)10-16(14)23-18(15)21/h8-10H,3-7,11H2,1-2H3,(H,19,20)
C18H22O5318.3643383000
20118120

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3-/t12-/m0/s1
C18H22O5318.3643343200
4524664

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+
C18H22O5318.36433186800
574195
InChI=1/C18H22O5/c1-6-21-17(20)16-11(2)23-14-8-7-12(9-13(14)16)22-10-15(19)18(3,4)5/h7-9H,6,10H2,1-5H3
C18H22O5318.3643291600
265712
InChI=1/C18H22O5/c1-19-15-7-3-5-9-17(15)22-13-11-21-12-14-23-18-10-6-4-8-16(18)20-2/h3-10H,11-14H2,1-2H3
C18H22O5318.3643271500
1390793
InChI=1/C18H22O5/c1-12(2)7-8-21-14-5-6-16-15(11-14)17(13(3)23-16)18(19)22-10-9-20-4/h5-7,11H,8-10H2,1-4H3
C18H22O5318.3643271600
9046134
InChI=1/C18H22O5/c1-10(2)16-13-7-11(18(19)23-6)8-14(20-3)12(13)9-15(21-4)17(16)22-5/h7-10H,1-6H3
C18H22O5318.3643262000
793234
InChI=1/C18H22O5/c1-5-21-15-9-7-13-11(3)14(8-10-16(19)22-6-2)18(20)23-17(13)12(15)4/h7,9H,5-6,8,10H2,1-4H3
C18H22O5318.3643261600
1382354
InChI=1/C18H22O5/c1-4-6-7-21-18(20)11-22-15-10-16-14(9-13(15)5-2)12(3)8-17(19)23-16/h8-10H,4-7,11H2,1-3H3
C18H22O5318.3643251400
592311
InChI=1/C18H22O5/c1-10(2)21-16(19)15-11(3)22-14-8-7-12(9-13(14)15)23-17(20)18(4,5)6/h7-10H,1-6H3
C18H22O5318.3643251200
2374794

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H22O5/c1-5-7-15-11(3)14-9-8-13(10-16(14)23-18(15)20)22-12(4)17(19)21-6-2/h8-10,12H,5-7H2,1-4H3
C18H22O5318.36428251300
2175822

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H22O5/c1-5-7-13-10-16(19)23-17-11(3)15(9-8-14(13)17)22-12(4)18(20)21-6-2/h8-10,12H,5-7H2,1-4H3
C18H22O5318.36428241700
778009
InChI=1/C18H22O5/c1-6-13-11(4)14-7-8-15(12(5)17(14)23-18(13)20)21-9-16(19)22-10(2)3/h7-8,10H,6,9H2,1-5H3
C18H22O5318.3643241700
1384171
InChI=1/C18H22O5/c1-5-6-9-22-15-8-7-13-11(2)14(10-16(19)21-4)18(20)23-17(13)12(15)3/h7-8H,5-6,9-10H2,1-4H3
C18H22O5318.3643241300
12345

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