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Carbamic acid, N-(2-benzoylphenyl)-, isobutyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Carbamic acid, N-(2-benzoylphenyl)-, isobutyl ester
SpectraBase Compound ID LfWrMoHKWzr
InChI InChI=1S/C18H19NO3/c1-13(2)12-22-18(21)19-16-11-7-6-10-15(16)17(20)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,21)
InChIKey LEFSAFYZHULITN-UHFFFAOYSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GoZdR0Sx9WH
Name Carbamic acid, N-(2-benzoylphenyl)-, isobutyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.136493473 u
Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-13(2)12-22-18(21)19-16-11-7-6-10-15(16)17(20)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,21)
InChIKey LEFSAFYZHULITN-UHFFFAOYSA-N
Molecular Weight 297.354 g/mol
SMILES C1=CC=C(C=C1)C(C=1C(NC(=O)OCC(C)C)=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812362