SpectraBase Spectrum ID |
1g3cm9f5nHH |
Name |
8.alpha.,Bromo-6.beta.,7.alpha.,9.beta.-trihydroxy-6,7,8,9-tetrahydro-4H-cyclopenta[def]chrysene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H15BrO3 |
InChI |
InChI=1S/C19H15BrO3/c20-16-18(22)15-11-5-4-8-2-1-3-9-6-10(14(11)13(8)9)7-12(15)17(21)19(16)23/h1-5,7,16-19,21-23H,6H2/t16-,17-,18+,19-/m1/s1 |
InChIKey |
AGHAJQGYFCMCNV-AKHDSKFASA-N |
Molecular Weight |
371.230 g/mol |
SMILES |
O[C@@]1(c2c([C@@]([C@]([C@]1(O)[H])(Br)[H])(O)[H])c1c3c(c2)Cc2cccc(cc1)c32)[H] |
SPLASH |
splash10-0zmr-0009000000-e02fa6eabc1a8f77bc73 |
Source of Spectrum |
J-60-4910-12 |
Synonyms |
(6R,7S,8R,9S)-8-bromo-6,7,8,9-tetrahydro-4H-cyclopenta[def]chrysene-6,7,9-triol |
Wiley ID |
1354148 |