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12H-benzo[b]phenoxazine, 2,4,11-trichloro-

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

12H-benzo[b]phenoxazine, 2,4,11-trichloro-
SpectraBase Compound ID FxqgvSvID7I
InChI InChI=1S/C16H8Cl3NO/c17-9-6-11(18)16-12(7-9)20-15-13(21-16)5-8-3-1-2-4-10(8)14(15)19/h1-7,20H
InChIKey QMRZBBFXYYVFDV-UHFFFAOYSA-N
Mol Weight 336.61 g/mol
Molecular Formula C16H8Cl3NO
Exact Mass 334.967147 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5rAxgGQZhTJ
Name 12H-Benzo[B]phenoxazine, 2,4,11-trichloro-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.967146981 u
Formula C16H8Cl3NO
InChI InChI=1S/C16H8Cl3NO/c17-9-6-11(18)16-12(7-9)20-15-13(21-16)5-8-3-1-2-4-10(8)14(15)19/h1-7,20H
InChIKey QMRZBBFXYYVFDV-UHFFFAOYSA-N
Molecular Weight 336.605 g/mol
SMILES C1(Cl)=CC(Cl)=C2OC3=CC=4C=CC=CC4C(Cl)=C3NC2=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90374