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N-allyl-N-[(E)-cinnamyl]carbamic acid tert-butyl ester

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

N-allyl-N-[(E)-cinnamyl]carbamic acid tert-butyl ester
SpectraBase Compound ID 6Z2Km9EDTOh
InChI InChI=1S/C17H23NO2/c1-5-13-18(16(19)20-17(2,3)4)14-9-12-15-10-7-6-8-11-15/h5-12H,1,13-14H2,2-4H3/b12-9+
InChIKey UPPWUIQBGVXPGN-FMIVXFBMSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7CGpsWIDU1T
Name N-Allyl-N-[(E)-cinnamyl]carbamic acid tert-butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.172878983 u
Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-5-13-18(16(19)20-17(2,3)4)14-9-12-15-10-7-6-8-11-15/h5-12H,1,13-14H2,2-4H3/b12-9+
InChIKey UPPWUIQBGVXPGN-FMIVXFBMSA-N
SMILES C(OC(C)(C)C)(N(C\C=C\C=1C=CC=CC1)CC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94178