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Carbonic acid, monoamide, N-(2-phenylethyl)-N-butyl-, propyl ester

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Carbonic acid, monoamide, N-(2-phenylethyl)-N-butyl-, propyl ester
SpectraBase Compound ID KbmRqSEL7Wa
InChI InChI=1S/C16H25NO2/c1-3-5-12-17(16(18)19-14-4-2)13-11-15-9-7-6-8-10-15/h6-10H,3-5,11-14H2,1-2H3
InChIKey JMLSGSVQKRKHKS-UHFFFAOYSA-N
Mol Weight 263.38 g/mol
Molecular Formula C16H25NO2
Exact Mass 263.188529 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EHfpQQb9KLE
Name Carbonic acid, monoamide, N-(2-phenylethyl)-N-butyl-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.188529047 u
Formula C16H25NO2
InChI InChI=1S/C16H25NO2/c1-3-5-12-17(16(18)19-14-4-2)13-11-15-9-7-6-8-10-15/h6-10H,3-5,11-14H2,1-2H3
InChIKey JMLSGSVQKRKHKS-UHFFFAOYSA-N
Molecular Weight 263.381 g/mol
SMILES CCCOC(=O)N(CCCC)CCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.841982