SpectraBase Spectrum ID |
IPnIz5To4rJ |
Name |
2-[(3'-Benzyloxy-4'-methoxyphenyl)thio]benzoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H18O4S |
InChI |
InChI=1S/C21H18O4S/c1-24-18-12-11-16(26-20-10-6-5-9-17(20)21(22)23)13-19(18)25-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,22,23) |
InChIKey |
VMXGZISIZFIVEG-UHFFFAOYSA-N |
Molecular Weight |
366.431 g/mol |
SMILES |
OC(c1c(Sc2cc(OCc3ccccc3)c(cc2)OC)cccc1)=O |
SPLASH |
splash10-0006-9100000000-a0615be81bafcdd7c6ca |
Source of Spectrum |
G-56-466-0 |
Synonyms |
2-{[3-(benzyloxy)-4-methoxyphenyl]sulfanyl}benzoic acid |
Wiley ID |
748387 |