| SpectraBase Spectrum ID |
5QnJjJfIHMQ |
| Name |
(all-Z)-3-Thiahenicosa-6,9,12,15,18-pentaen-2-one |
| Alternate Name(s) |
ethanethioic acid S-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenyl]ester
S-[(3Z,6Z,9Z,12Z,15Z)-3,6,9,12,15-octadecapentaenyl]ethanethioate
S-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenyl]ethanethioate
S-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenyl] ethanethioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30OS |
| InChI |
InChI=1S/C20H30OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-19H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16- |
| InChIKey |
HGUBXPDBYIIBPP-JEBPEJKESA-N |
| Molecular Weight |
318.519 g/mol |
| SMILES |
C(=O)(SCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)C |
| SPLASH |
splash10-0006-9000000000-0a67adce1c072b442dbf |
| Source of Spectrum |
KC-0-2274-13 |
| Wiley ID |
831279 |
