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Butanoic acid, 4-[[(dimethylamino)methylene]amino]-, methyl ester

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

Butanoic acid, 4-[[(dimethylamino)methylene]amino]-, methyl ester
SpectraBase Compound ID FUjuYBFnEwp
InChI InChI=1S/C8H16N2O2/c1-10(2)7-9-6-4-5-8(11)12-3/h7H,4-6H2,1-3H3/b9-7+
InChIKey PEISWZHPJQFQDM-VQHVLOKHSA-N
Mol Weight 172.23 g/mol
Molecular Formula C8H16N2O2
Exact Mass 172.121178 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9mNItt76tqI
Name Butanoic acid, 4-[[(dimethylamino)methylene]amino]-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.121177761 u
Formula C8H16N2O2
InChI InChI=1S/C8H16N2O2/c1-10(2)7-9-6-4-5-8(11)12-3/h7H,4-6H2,1-3H3/b9-7+
InChIKey PEISWZHPJQFQDM-VQHVLOKHSA-N
Molecular Weight 172.228 g/mol
SMILES C(\N=C\N(C)C)CCC(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952488