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Butanoic acid, 2-(1-methyl-2-pyrrolidinylidene)-3-oxo-, methyl ester

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Butanoic acid, 2-(1-methyl-2-pyrrolidinylidene)-3-oxo-, methyl ester
SpectraBase Compound ID 52Sbti803GA
InChI InChI=1S/C10H15NO3/c1-7(12)9(10(13)14-3)8-5-4-6-11(8)2/h4-6H2,1-3H3/b9-8+
InChIKey JDCBJLDBBBMNMO-CMDGGOBGSA-N
Mol Weight 197.23 g/mol
Molecular Formula C10H15NO3
Exact Mass 197.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9JYoQlUJ7B1
Name Butanoic acid, 2-(1-methyl-2-pyrrolidinylidene)-3-oxo-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 197.105193344 u
Formula C10H15NO3
InChI InChI=1S/C10H15NO3/c1-7(12)9(10(13)14-3)8-5-4-6-11(8)2/h4-6H2,1-3H3/b9-8+
InChIKey JDCBJLDBBBMNMO-CMDGGOBGSA-N
Molecular Weight 197.234 g/mol
SMILES C1N(\C(=C\(C(=O)OC)C(=O)C)CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978115