| SpectraBase Spectrum ID |
E0A3pZFE0Oc |
| Name |
(E,E)-1-Methoxycarboxy-4-phenylthiobuta-1,3-diene |
| Alternate Name(s) |
Methyl (2E,4E)-5-(phenylsulfanyl)-2,4-pentadieneperoxoate |
| CAS Registry Number |
67700-06-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O3S |
| InChI |
InChI=1S/C12H12O3S/c1-14-15-12(13)9-5-6-10-16-11-7-3-2-4-8-11/h2-10H,1H3/b9-5+,10-6+ |
| InChIKey |
OJJJIVZZEOUOCE-NXZHAISVSA-N |
| Molecular Weight |
236.285 g/mol |
| SMILES |
C(\C=C\C=C\Sc1ccccc1)(=O)OOC |
| SPLASH |
splash10-0ap0-6930000000-314cec5e13d72405f38a |
| Source of Spectrum |
J-43-4562-0 |
| Wiley ID |
1237780 |
