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2-Methyldibenzo[b,f][1,4]oxazepin-11(10H)-one

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

2-Methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
SpectraBase Compound ID A2wS90BbxB1
InChI InChI=1S/C14H11NO2/c1-9-6-7-12-10(8-9)14(16)15-11-4-2-3-5-13(11)17-12/h2-8H,1H3,(H,15,16)
InChIKey CEDPAOBVDUYLDI-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C14H11NO2
Exact Mass 225.078979 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1hG7zH8eWRJ
Name 2-Methyldibenzo[B,F][1,4]oxazepin-11(10H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.078978596 u
Formula C14H11NO2
InChI InChI=1S/C14H11NO2/c1-9-6-7-12-10(8-9)14(16)15-11-4-2-3-5-13(11)17-12/h2-8H,1H3,(H,15,16)
InChIKey CEDPAOBVDUYLDI-UHFFFAOYSA-N
Molecular Weight 225.247 g/mol
SMILES C=12OC=3C(C(NC2=CC=CC1)=O)=CC(=CC3)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899049