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2,6-Dimethylcarbanilic acid, (1-ethyl-3-pyrrolidinyl)methyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

2,6-Dimethylcarbanilic acid, (1-ethyl-3-pyrrolidinyl)methyl ester
SpectraBase Compound ID LTCWNprOZ4n
InChI InChI=1S/C16H24N2O2/c1-4-18-9-8-14(10-18)11-20-16(19)17-15-12(2)6-5-7-13(15)3/h5-7,14H,4,8-11H2,1-3H3,(H,17,19)
InChIKey UPNBIUSCGLCACQ-UHFFFAOYSA-N
Mol Weight 276.38 g/mol
Molecular Formula C16H24N2O2
Exact Mass 276.183778 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4aYwegi29cM
Name 2,6-Dimethylcarbanilic acid, (1-ethyl-3-pyrrolidinyl)methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.183778019 u
Formula C16H24N2O2
InChI InChI=1S/C16H24N2O2/c1-4-18-9-8-14(10-18)11-20-16(19)17-15-12(2)6-5-7-13(15)3/h5-7,14H,4,8-11H2,1-3H3,(H,17,19)
InChIKey UPNBIUSCGLCACQ-UHFFFAOYSA-N
Molecular Weight 276.380 g/mol
SMILES N(C=1C(=CC=CC1C)C)C(OCC1CCN(C1)CC)=O
Spectrum/Structure Validation Score (Raman) 0.939323