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4-Pyridinepropanoic acid, 1-acetyl-1,2,3,6-tetrahydro-.beta.-methyl-, methyl ester
SpectraBase Compound ID HTjEEJ86O7h
InChI InChI=1S/C12H19NO3/c1-9(8-12(15)16-3)11-4-6-13(7-5-11)10(2)14/h4,9H,5-8H2,1-3H3
InChIKey DICGFCTYXZIKBY-UHFFFAOYSA-N
Mol Weight 225.29 g/mol
Molecular Formula C12H19NO3
Exact Mass 225.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rzQZrxg1mH
Name 4-Pyridinepropanoic acid, 1-acetyl-1,2,3,6-tetrahydro-.beta.-methyl-, methyl ester
CAS Registry Number 67428-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO3
InChI InChI=1S/C12H19NO3/c1-9(8-12(15)16-3)11-4-6-13(7-5-11)10(2)14/h4,9H,5-8H2,1-3H3
InChIKey DICGFCTYXZIKBY-UHFFFAOYSA-N
Molecular Weight 225.288 g/mol
SMILES C(N1CC=C(CC1)C(CC(=O)OC)C)(=O)C
SPLASH splash10-0006-9510000000-5d925a2926dee4d2c4da
Source of Spectrum C-100-3424-0
Synonyms 1-Acetyl-4-(1'-methyl-2'-methoxycarbonylethyl)-1,2,3,6-tetrahydropyridine Methyl 3-(1-acetyl-1,2,3,6-tetrahydro-4-pyridinyl)butanoate
Wiley ID 1226381