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1-Demethyl phenazolam

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

1-Demethyl phenazolam
SpectraBase Compound ID 6CB49cnjFBn
InChI InChI=1S/C16H10BrClN4/c17-10-5-6-14-12(7-10)16(11-3-1-2-4-13(11)18)19-8-15-21-20-9-22(14)15/h1-7,9H,8H2
InChIKey HGHGSOBPNPCMHF-UHFFFAOYSA-N
Mol Weight 373.64 g/mol
Molecular Formula C16H10BrClN4
Exact Mass 371.977737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cyla22jUroI
Name 1-demethyl Phenazolam
Catalog Number 23525
CAS Registry Number 919973-69-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10BrClN4
InChI InChI=1S/C16H10BrClN4/c17-10-5-6-14-12(7-10)16(11-3-1-2-4-13(11)18)19-8-15-21-20-9-22(14)15/h1-7,9H,8H2
InChIKey HGHGSOBPNPCMHF-UHFFFAOYSA-N
Molecular Weight 373.641 g/mol
SMILES c1(Br)ccc-2c(C(c3ccccc3Cl)=NCc3nnc[n]23)c1
SPLASH splash10-0fmi-5975000000-963031165b1145b922e1
Source of Spectrum CAY-2023-534-0
Wiley ID 1888494