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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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Isotopically Labeled
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Found 1070 results

Search term: C21H22O4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4477422

Double-bond stereo
InChI=1/C21H22O4/c1-5-21(2,3)17-12-15(20(25-4)13-19(17)24)8-11-18(23)14-6-9-16(22)10-7-14/h5-13,22,24H,1H2,2-4H3/b11-8+
C21H22O4338.39787837711
4581520

Double-bond stereo
InChI=1/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-16-7-8-20(22)25-19(16)13-18-17(21)10-12-23-18/h5,7-10,12-13H,4,6,11H2,1-3H3/b15-9+
C21H22O4338.39774141876
4476408

Double-bond stereo
InChI=1/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-19-17(10-12-23-19)13-16-7-8-18(22)25-20(16)21/h5,7-10,12-13H,4,6,11H2,1-3H3/b15-9+
C21H22O4338.397676200
8512670

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H22O4/c1-13(2)4-5-15-10-17-18(23)11-20(14-6-8-16(22)9-7-14)25-21(17)12-19(15)24-3/h4,6-10,12,20,22H,5,11H2,1-3H3/t20-/m0/s1
C21H22O4338.397514900
4479431

Double-bond stereo
InChI=1/C21H22O4/c1-14(2)4-8-16-12-18(20(24)13-21(16)25-3)19(23)11-7-15-5-9-17(22)10-6-15/h4-7,9-13,22,24H,8H2,1-3H3/b11-7+
C21H22O4338.397505400
109499

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22O4/c1-13(2)4-5-15-10-17-18(23)11-20(14-6-8-16(22)9-7-14)25-21(17)12-19(15)24-3/h4,6-10,12,20,22H,5,11H2,1-3H3
C21H22O4338.397425020
8016522

Double-bond stereo
InChI=1/C21H22O4/c1-14(2)4-11-18-20(24)13-8-16(21(18)25-3)7-12-19(23)15-5-9-17(22)10-6-15/h4-10,12-13,22,24H,11H2,1-3H3/b12-7+
C21H22O4338.397414200
4942973

Double-bond stereo
InChI=1/C21H22O4/c1-14(2)4-10-18-20(25-3)13-11-17(21(18)24)19(23)12-7-15-5-8-16(22)9-6-15/h4-9,11-13,22,24H,10H2,1-3H3/b12-7+
C21H22O4338.397364500
773570
InChI=1/C21H22O4/c1-4-5-16-12-20(22)25-21-14(2)19(11-10-18(16)21)24-13-15-6-8-17(23-3)9-7-15/h6-12H,4-5,13H2,1-3H3
C21H22O4338.397271300
1272693
InChI=1/C21H22O4/c1-4-5-8-23-16-6-7-18-19(12-16)24-13-20(21(18)22)25-17-10-14(2)9-15(3)11-17/h6-7,9-13H,4-5,8H2,1-3H3
C21H22O4338.397271500
1273119
InChI=1/C21H22O4/c1-3-4-5-11-23-16-9-10-18-19(13-16)24-14-20(21(18)22)25-17-8-6-7-15(2)12-17/h6-10,12-14H,3-5,11H2,1-2H3
C21H22O4338.397271500
1400679
InChI=1/C21H22O4/c1-3-4-7-16-12-21(22)25-20-13-18(9-10-19(16)20)24-14-15-6-5-8-17(11-15)23-2/h5-6,8-13H,3-4,7,14H2,1-2H3
C21H22O4338.397261300
611895
InChI=1/C21H22O4/c1-5-23-21(22)20-15(4)25-19-9-8-17(11-18(19)20)24-12-16-10-13(2)6-7-14(16)3/h6-11H,5,12H2,1-4H3
C21H22O4338.397261500
611921
InChI=1/C21H22O4/c1-13(2)24-21(22)20-15(4)25-19-10-9-17(11-18(19)20)23-12-16-8-6-5-7-14(16)3/h5-11,13H,12H2,1-4H3
C21H22O4338.397251400
773627
InChI=1/C21H22O4/c1-4-6-16-12-20(22)25-21-14(2)19(10-9-18(16)21)24-13-15-7-5-8-17(11-15)23-3/h5,7-12H,4,6,13H2,1-3H3
C21H22O4338.397251400
1728886
InChI=1/C21H22O4/c1-3-10-23-16-12-19(24-11-4-2)21-17(22)14-18(25-20(21)13-16)15-8-6-5-7-9-15/h5-9,12-14H,3-4,10-11H2,1-2H3
C21H22O4338.397251400
793104
InChI=1/C21H22O4/c1-4-6-16-12-20(22)25-19-10-14(2)9-18(21(16)19)24-13-15-7-5-8-17(11-15)23-3/h5,7-12H,4,6,13H2,1-3H3
C21H22O4338.397241400
628424
InChI=1/C21H22O4/c1-5-23-16-10-11-17-18(12-16)24-13-19(20(17)22)25-15-8-6-14(7-9-15)21(2,3)4/h6-13H,5H2,1-4H3
C21H22O4338.397241300
652580
InChI=1/C21H22O4/c1-4-6-15-7-9-16(10-8-15)25-21-14(3)24-19-13-17(23-5-2)11-12-18(19)20(21)22/h7-13H,4-6H2,1-3H3
C21H22O4338.397241500
1447709
InChI=1/C21H22O4/c1-3-4-5-16-12-21(22)25-20-13-18(10-11-19(16)20)24-14-15-6-8-17(23-2)9-7-15/h6-13H,3-5,14H2,1-2H3
C21H22O4338.397241500
12345

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