SpectraBase Spectrum ID |
8VDWfAYkVYx |
Name |
Benzo[g]chrysene-5,6-diol, 5,6,7,8-tetrahydro-, diacetate, trans-(.+-.)- |
CAS Registry Number |
110971-60-3 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H22O4 |
InChI |
InChI=1S/C26H22O4/c1-15(27)29-23-14-13-22-21-12-11-17-7-3-4-8-18(17)24(21)19-9-5-6-10-20(19)25(22)26(23)30-16(2)28/h3-12,23,26H,13-14H2,1-2H3/t23-,26+/m0/s1 |
InChIKey |
MJOKIYDGCSAYNS-JYFHCDHNSA-N |
Molecular Weight |
398.458 g/mol |
SMILES |
c12c(c3ccc4c(c3c3c2cccc3)cccc4)CC[C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H] |
SPLASH |
splash10-0002-0094000000-f026c10b4570beeef53d |
Source of Spectrum |
J-52-5581-17 |
Synonyms |
(5S,6S)-5-(acetyloxy)-5,6,7,8-tetrahydrobenzo[g]chrysen-6-yl acetate
trans-5,6-diacetoxy-5,6,7,8-tetrahydrobenzo[g]chrysene |
Wiley ID |
1368631 |