SpectraBase Spectrum ID |
FJvS8YUnOxj |
Name |
Benzo[g]chrysene-3,4-diol, 1,2,3,4-tetrahydro-, diacetate, trans-(.+-.)- |
CAS Registry Number |
110971-57-8 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H22O4 |
InChI |
InChI=1S/C26H22O4/c1-15(27)29-23-14-13-22-24-18-8-4-3-7-17(18)11-12-21(24)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 |
JKISNEPGBMCGJL-JYFHCDHNSA-N |
Molecular Weight |
398.458 g/mol |
SMILES |
c12c(c3c4c(cccc4)ccc3c3c1cccc3)CC[C@@]([C@]2(OC(=O)C)[H])(OC(=O)C)[H] |
SPLASH |
splash10-002s-0091000000-c607a265fc394c8eedf2 |
Source of Spectrum |
J-52-5580-13 |
Synonyms |
(3S,4S)-3-(acetyloxy)-1,2,3,4-tetrahydrobenzo[g]chrysen-4-yl acetate
trans-3,4-diacetoxy-1,2,3,4-tetrahydrobenzo[g]chrysene |
Wiley ID |
1368630 |