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Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, benzyl ester

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Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, benzyl ester
SpectraBase Compound ID GpCftnXhk1o
InChI InChI=1S/C16H25NO2/c1-4-11-17(12-10-14(2)3)16(18)19-13-15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3
InChIKey SZLNIRDDIKURCH-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 C8aRQ3LNor7
Name Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, benzyl 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/c1-4-11-17(12-10-14(2)3)16(18)19-13-15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3
InChIKey SZLNIRDDIKURCH-UHFFFAOYSA-N
Molecular Weight 263.381 g/mol
SMILES C(N(CCC)CCC(C)C)(=O)OCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937867