| SpectraBase Spectrum ID |
5T4eaho2iHF |
| Name |
2-(p-tolylsulfonyl)-3-ethenyloctanoic acid methyl ester |
| Alternate Name(s) |
Methyl 2-[(4-methylphenyl)sulfonyl]-3-pentyl-4-pentenoate |
| CAS Registry Number |
113558-52-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26O4S |
| InChI |
InChI=1S/C18H26O4S/c1-5-7-8-9-15(6-2)17(18(19)22-4)23(20,21)16-12-10-14(3)11-13-16/h6,10-13,15,17H,2,5,7-9H2,1,3-4H3 |
| InChIKey |
BORIRCCXPNGRNA-UHFFFAOYSA-N |
| Molecular Weight |
338.462 g/mol |
| SMILES |
C(S(c1ccc(cc1)C)(=O)=O)(C(=O)OC)C(C=C)CCCCC |
| SPLASH |
splash10-001i-5900000000-9d859780796fe641f687 |
| Source of Spectrum |
AJ-60-3432-5 |
| Wiley ID |
1333656 |
