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(3-Amino-3-oxopropyl)(benzyl)carbamic fluoride

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

(3-Amino-3-oxopropyl)(benzyl)carbamic fluoride
SpectraBase Compound ID 1MO6peRdw8l
InChI InChI=1S/C11H13FN2O2/c12-11(16)14(7-6-10(13)15)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,13,15)
InChIKey ANZIPVUQSHTXLN-UHFFFAOYSA-N
Mol Weight 224.24 g/mol
Molecular Formula C11H13FN2O2
Exact Mass 224.096106 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DM6h2rfpLWi
Name (3-Amino-3-oxopropyl)(benzyl)carbamic fluoride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.096105828 u
Formula C11H13FN2O2
InChI InChI=1S/C11H13FN2O2/c12-11(16)14(7-6-10(13)15)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,13,15)
InChIKey ANZIPVUQSHTXLN-UHFFFAOYSA-N
Molecular Weight 224.235 g/mol
SMILES C(N(CC1=CC=CC=C1)C(=O)F)CC(N)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951929