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[(Allyl)(tert-butoxycarbonyl)amino]acetonitrile

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

[(Allyl)(tert-butoxycarbonyl)amino]acetonitrile
SpectraBase Compound ID Bb9aMzog4Lz
InChI InChI=1S/C10H16N2O2/c1-5-7-12(8-6-11)9(13)14-10(2,3)4/h5H,1,7-8H2,2-4H3
InChIKey XKYHFSITLFSMEU-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C10H16N2O2
Exact Mass 196.121178 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ih4cNxbI7Ll
Name [(Allyl)(tert-butoxycarbonyl)amino]acetonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.121177761 u
Formula C10H16N2O2
InChI InChI=1S/C10H16N2O2/c1-5-7-12(8-6-11)9(13)14-10(2,3)4/h5H,1,7-8H2,2-4H3
InChIKey XKYHFSITLFSMEU-UHFFFAOYSA-N
Molecular Weight 196.250 g/mol
SMILES C(OC(C)(C)C)(N(CC#N)CC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952692