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(phenylmethyl) N-(5-oxidanylideneundecyl)carbamate

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

(phenylmethyl) N-(5-oxidanylideneundecyl)carbamate
SpectraBase Compound ID 8XdA6vtcixM
InChI InChI=1S/C19H29NO3/c1-2-3-4-8-13-18(21)14-9-10-15-20-19(22)23-16-17-11-6-5-7-12-17/h5-7,11-12H,2-4,8-10,13-16H2,1H3,(H,20,22)
InChIKey ZPARNFHASCQWTK-UHFFFAOYSA-N
Mol Weight 319.45 g/mol
Molecular Formula C19H29NO3
Exact Mass 319.214744 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H2990BWKjsb
Name (Phenylmethyl) N-(5-oxidanylideneundecyl)carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.214743795 u
Formula C19H29NO3
InChI InChI=1S/C19H29NO3/c1-2-3-4-8-13-18(21)14-9-10-15-20-19(22)23-16-17-11-6-5-7-12-17/h5-7,11-12H,2-4,8-10,13-16H2,1H3,(H,20,22)
InChIKey ZPARNFHASCQWTK-UHFFFAOYSA-N
Molecular Weight 319.445 g/mol
SMILES C(=O)(OCC=1C=CC=CC1)NCCCCC(=O)CCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.808428