SpectraBase Spectrum ID |
oU88eErjl6 |
Name |
trans-3-bromo-4-acetoxy-7,12-dimethyl-1,2,3,4-tetrahydrobenz[5,6-a]anthracene |
Alternate Name(s) |
(3S,4S)-3-bromo-7,12-dimethyl-1,2,3,4-tetrahydrobenzo[a]anthracen-4-yl acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H21BrO2 |
InChI |
InChI=1S/C22H21BrO2/c1-12-15-6-4-5-7-16(15)13(2)21-17(12)8-9-19-18(21)10-11-20(23)22(19)25-14(3)24/h4-9,20,22H,10-11H2,1-3H3/t20-,22-/m0/s1 |
InChIKey |
TUOGVACVEJVTHS-UNMCSNQZSA-N |
Molecular Weight |
397.312 g/mol |
SMILES |
c12c3c([C@](OC(=O)C)([C@](CC3)(Br)[H])[H])ccc1c(C)c1c(c2C)cccc1 |
SPLASH |
splash10-0a4i-0091000000-ca14e3edf79b69e11d09 |
Source of Spectrum |
J-54-857-34 |
Wiley ID |
1367450 |