| SpectraBase Spectrum ID |
7wjIcsE0dtP |
| Name |
Methyl 5-hydroxy-5-methyl-3-(phenylthio)hex-2-enoate |
| CAS Registry Number |
102736-29-8 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O3S |
| InChI |
InChI=1S/C14H18O3S/c1-14(2,16)10-12(9-13(15)17-3)18-11-7-5-4-6-8-11/h4-9,16H,10H2,1-3H3/b12-9+ |
| InChIKey |
UZKVVOPRZVFPTA-FMIVXFBMSA-N |
| Molecular Weight |
266.355 g/mol |
| SMILES |
OC(C\C(=C/C(=O)OC)Sc1ccccc1)(C)C |
| SPLASH |
splash10-0bvj-4920000000-fdc8780af8ea3c66140b |
| Source of Spectrum |
J-51-3015-6 |
| Synonyms |
Methyl (2E)-5-hydroxy-5-methyl-3-(phenylsulfanyl)-2-hexenoate |
| Wiley ID |
1269817 |
