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Acetic acid, 2-(6,7-dihydro-3-cyano-5H-cyclopenta[b]pyridin-2-ylthio)-, octyl ester
SpectraBase Compound ID EZ0vH7w7HVB
InChI InChI=1S/C19H26N2O2S/c1-2-3-4-5-6-7-11-23-18(22)14-24-19-16(13-20)12-15-9-8-10-17(15)21-19/h12H,2-11,14H2,1H3
InChIKey HEZRKIJICUIEEJ-UHFFFAOYSA-N
Mol Weight 346.49 g/mol
Molecular Formula C19H26N2O2S
Exact Mass 346.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qB9XXDSDCi
Name Acetic acid, 2-(6,7-dihydro-3-cyano-5H-cyclopenta[b]pyridin-2-ylthio)-, octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26N2O2S
InChI InChI=1S/C19H26N2O2S/c1-2-3-4-5-6-7-11-23-18(22)14-24-19-16(13-20)12-15-9-8-10-17(15)21-19/h12H,2-11,14H2,1H3
InChIKey HEZRKIJICUIEEJ-UHFFFAOYSA-N
Molecular Weight 346.489 g/mol
SMILES CCCCCCCCOC(CSc1c(C#N)cc2c(n1)CCC2)=O
SPLASH splash10-000f-6920000000-f61176dc6f00f95027f3
Source of Spectrum AD-0-2532-0
Synonyms 2-[(3-cyano-1-pyrindan-2-yl)thio]acetic acid octyl ester 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]acetic acid octyl ester Octyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate Octyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]ethanoate
Wiley ID 1419653