| SpectraBase Spectrum ID |
5141IBjYXo |
| Name |
1-Mercapto-2,3-bis(4-methoxyphenyl)hepta-1,3-dien-5-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O3S |
| InChI |
InChI=1S/C21H22O3S/c1-4-17(22)13-20(15-5-9-18(23-2)10-6-15)21(14-25)16-7-11-19(24-3)12-8-16/h5-14,25H,4H2,1-3H3/b20-13+,21-14+ |
| InChIKey |
CARCPHRSHQMQSC-KVVJQUGZSA-N |
| Molecular Weight |
354.464 g/mol |
| SMILES |
S\C=C\(\C(=C\C(CC)=O)c1ccc(cc1)OC)c1ccc(cc1)OC |
| SPLASH |
splash10-0f79-0709000000-fce5a37cc810907e2d63 |
| Source of Spectrum |
SO-64-516-4 |
| Synonyms |
(4E,6E)-5,6-bis(4-methoxyphenyl)-7-sulfanyl-4,6-heptadien-3-one |
| Wiley ID |
1540746 |
