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3-Thiophenecarboxylic acid, 5-phenyl-2-(1-piperidinyl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

3-Thiophenecarboxylic acid, 5-phenyl-2-(1-piperidinyl)-, methyl ester
SpectraBase Compound ID 6unkt7KFxm6
InChI InChI=1S/C17H19NO2S/c1-20-17(19)14-12-15(13-8-4-2-5-9-13)21-16(14)18-10-6-3-7-11-18/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
InChIKey KVYHCIOQLARGNT-UHFFFAOYSA-N
Mol Weight 301.4 g/mol
Molecular Formula C17H19NO2S
Exact Mass 301.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DdE0p8L7H1
Name 3-Thiophenecarboxylic acid, 5-phenyl-2-(1-piperidinyl)-, methyl ester
Alternate Name(s) 5-Phenyl-2-piperidino-3-thiophencarboxylic acidmethyl ester Methyl 5-phenyl-2-(1-piperidinyl)-3-thiophenecarboxylate
CAS Registry Number 67139-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO2S
InChI InChI=1S/C17H19NO2S/c1-20-17(19)14-12-15(13-8-4-2-5-9-13)21-16(14)18-10-6-3-7-11-18/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
InChIKey KVYHCIOQLARGNT-UHFFFAOYSA-N
Molecular Weight 301.404 g/mol
SMILES c1(c(sc(c1)-c1ccccc1)N1CCCCC1)C(=O)OC
SPLASH splash10-0udi-0029000000-84493855e6561fcf5aeb
Source of Spectrum K-111-2033-4
Wiley ID 1303815