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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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 31 results

Search term: WDXRGPWQVHZTQJ (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4952892

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18+,20+,21-/m1/s1
C21H28O2312.44587490963
4944297


Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4-/t15-,17+,18+,20+,21-/m1/s1
C21H28O2312.4458526711
21475090

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1
C21H28O2312.4458181600
5007305

Double-bond stereo

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15?,17?,18?,20-,21+/m0/s1
C21H28O2312.44588500
4952891

Double-bond stereo

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4-/t15?,17?,18?,20-,21+/m0/s1
C21H28O2312.44586600
5036166

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18-,20-,21+/m1/s1
C21H28O2312.44583300
26401068

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4-/t15-,17+,18+,20-,21+/m0/s1
C21H28O2312.44583600
32822011

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18-,20-,21-/m0/s1
C21H28O2312.44583200
62416537

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17-,18-,20+,21-/m1/s1
C21H28O2312.44583600
62416535

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17-,18-,20-,21+/m0/s1
C21H28O2312.44583300
62416536

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18+,20-,21+/m0/s1
C21H28O2312.44582200
82965513

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18+,20+,21-/m0/s1
C21H28O2312.44582100
62416538

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17-,18+,20-,21+/m0/s1
C21H28O2312.44582200
62416539

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18-,20+,21-/m1/s1
C21H28O2312.44582200
62416533

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17+,18-,20-,21+/m0/s1
C21H28O2312.44582200
62416534

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4+/t15-,17-,18+,20+,21-/m1/s1
C21H28O2312.44582200
32821945

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4-/t15-,17+,18-,20-,21-/m0/s1
C21H28O2312.44582100
82827490

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/b16-4-/t15-,17+,18+,20+,21-/m0/s1
C21H28O2312.44581200
113609987

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17-,18-,20-,21-/m0/s1
C21H28O2312.44581100
12

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