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

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

4-Hydroxydibenz[b,f][1,4]oxazepin-11(10H)-one
SpectraBase Compound ID KPxP3UbPHyj
InChI InChI=1S/C13H9NO3/c15-10-6-3-4-8-12(10)17-11-7-2-1-5-9(11)14-13(8)16/h1-7,15H,(H,14,16)
InChIKey UGUUPUTWIBQGDO-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C13H9NO3
Exact Mass 227.058243 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LrnIE4pBxrV
Name 4-Hydroxydibenz[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 227.058243151 u
Formula C13H9NO3
InChI InChI=1S/C13H9NO3/c15-10-6-3-4-8-12(10)17-11-7-2-1-5-9(11)14-13(8)16/h1-7,15H,(H,14,16)
InChIKey UGUUPUTWIBQGDO-UHFFFAOYSA-N
Molecular Weight 227.219 g/mol
SMILES C1(C=2C(OC=3C(N1)=CC=CC3)=C(O)C=CC2)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.98027