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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 14 results

Search term: JSPGKOBNHWTKNT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4580432

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
C30H50O2442.7168242200
4521022

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+
C30H50O2442.7168131900
348879

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
C30H50O2442.71683200
434841

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3
C30H50O2442.71682100
4475333

Double-bond stereo

6 of 9 defined stereocentres - 6/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20?,21-,22?,23+,24+,27-,28?,29-,30+/m1/s1
C30H50O2442.71682200
8224589

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8-/t20-,21-,22?,23+,24+,27-,28+,29-,30+/m1/s1
C30H50O2442.71682100
8247611

Double-bond stereo

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22?,23?,24+,27-,28+,29-,30+/m1/s1
C30H50O2442.71682100
60601076

Double-bond stereo

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22?,23+,24+,27-,28+,29-,30?/m1/s1
C30H50O2442.71681100
82965492

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m0/s1
C30H50O2442.71681100
95532349

Double-bond stereo

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20?,21-,22+,23+,24?,27-,28+,29-,30+/m1/s1
C30H50O2442.71681100
113385375

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8-/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
C30H50O2442.71681100
113609065

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21+,22+,23+,24+,27-,28+,29+,30+/m1/s1
C30H50O2442.71681100
114814682

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23-,24+,27+,28+,29+,30+/m1/s1
C30H50O2442.71681100
115015532

Double-bond stereo

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21?,22+,23+,24+,27-,28+,29-,30?/m1/s1
C30H50O2442.71681100

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