SpectraBase Spectrum ID |
2DH7rTHwaQy |
Name |
Methyl 4-methyl-5-(2-bromoethyl)-2-(4-ethylphenylsulfanyl)-6-phenylbenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H25BrO2S |
InChI |
InChI=1S/C25H25BrO2S/c1-4-18-10-12-20(13-11-18)29-22-16-17(2)21(14-15-26)23(24(22)25(27)28-3)19-8-6-5-7-9-19/h5-13,16H,4,14-15H2,1-3H3 |
InChIKey |
VYMHIJFTNLCYHG-UHFFFAOYSA-N |
Molecular Weight |
469.437 g/mol |
SMILES |
c1(c(c(CCBr)c(cc1Sc1ccc(cc1)CC)C)-c1ccccc1)C(=O)OC |
SPLASH |
splash10-01b9-0042900000-c65c20cdc48c38b8c4cc |
Source of Spectrum |
F-65-7571-8u |
Wiley ID |
1680404 |