SpectraBase Spectrum ID |
EPIj3Qza93r |
Name |
Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-4-(2-pyridinylthio)-, methyl ester |
CAS Registry Number |
67012-87-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H23NO3S |
InChI |
InChI=1S/C18H23NO3S/c1-3-4-5-8-14-13(12-17(20)22-2)11-15(18(14)21)23-16-9-6-7-10-19-16/h4-7,9-10,13-15H,3,8,11-12H2,1-2H3/b5-4- |
InChIKey |
JFFSAFYWLCFQQA-PLNGDYQASA-N |
Molecular Weight |
333.446 g/mol |
SMILES |
C1(C(Sc2ncccc2)CC(C1C\C=C/CC)CC(=O)OC)=O |
SPLASH |
splash10-03di-9700000000-8db4b2bf968696f95ccf |
Source of Spectrum |
H-61-1001-0 |
Synonyms |
(Z)-3-Methoxycarbonylmethyl-2-(pent-2-enyl)-5-(pyridyl-2-thiyl)cyclopentanone
Methyl[3-oxo-2-[(2Z)-2-pentenyl]-4-(2-pyridinylsulfanyl)cyclopentyl]acetate |
Wiley ID |
1330199 |