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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 18 results

Search term: CWVMWSZEMZOUPC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
64682

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16+,18-,19-/m0/s1
C19H29BrO2369.3364212100
8514524

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16-,18-,19-/m0/s1
C19H29BrO2369.33649700
17346410

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13+,14-,15-,16-,18-,19-/m0/s1
C19H29BrO2369.33648600
23621211

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13+,14-,15-,16+,18-,19-/m0/s1
C19H29BrO2369.33647800
57260286

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11?,12-,13-,14+,15+,16-,18+,19+/m1/s1
C19H29BrO2369.33644300
3757641

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3
C19H29BrO2369.336364800
8984515

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16+,18-,19-/m0/s1/i9+2
C1814CH29BrO2371.32893200
9614946

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11?,12-,13?,14?,15?,16+,18-,19-/m0/s1
C19H29BrO2369.33642100
9901278

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13?,14?,15?,16+,18-,19-/m0/s1
C19H29BrO2369.33642100
8818313

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16-,18-,19-/m0/s1/i9+2
C1814CH29BrO2371.32892200
10536355

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15?,16+,18-,19-/m0/s1
C19H29BrO2369.33641100
57422648

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11?,12-,13-,14+,15+,16+,18+,19+/m1/s1
C19H29BrO2369.33641100
58819368

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11?,12-,13+,14-,15-,16?,18-,19-/m0/s1
C19H29BrO2369.33641100
107444253

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13?,14-,15-,16+,18-,19-/m0/s1
C19H29BrO2369.33641400
17592635

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13-,14+,15+,16+,18+,19+/m1/s1
C19H29BrO2369.33641100
17592636

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13-,14+,15+,16-,18+,19+/m1/s1
C19H29BrO2369.33641100
21203948

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12-,13+,14-,15+,16+,18-,19+/m1/s1
C19H29BrO2369.33641100
24817203

2 of 8 defined stereocentres - 2/8 defined
InChI=1/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11?,12?,13?,14?,15?,16?,18-,19+/m1/s1
C19H29BrO2369.33641100

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