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Flualprazolam
SpectraBase Compound ID 5woMaaWgTUK
InChI InChI=1S/C17H12ClFN4/c1-10-21-22-16-9-20-17(12-4-2-3-5-14(12)19)13-8-11(18)6-7-15(13)23(10)16/h2-8H,9H2,1H3
InChIKey MPZVLJCMGPYWQQ-UHFFFAOYSA-N
Mol Weight 326.76 g/mol
Molecular Formula C17H12ClFN4
Exact Mass 326.073452 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID GwG65OWQneP
Name Flualprazolam
Source of Sample Cayman Chemical Company
Catalog Number 24481
Lot Number 0526790-2
CAS Registry Number 28910-91-0
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClFN4
IUPAC Name 8-Chloro-6-(2-fluorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
InChI InChI=1S/C17H12ClFN4/c1-10-21-22-16-9-20-17(12-4-2-3-5-14(12)19)13-8-11(18)6-7-15(13)23(10)16/h2-8H,9H2,1H3
InChIKey MPZVLJCMGPYWQQ-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 1002 mW
Raman Laser Source Nd:YAG
SMILES c1cc(c(cc1)F)C=1c2cc(ccc2-[n]2c(nnc2CN1)C)Cl
Scans Performed 3392
Source of Spectrum Forensic Spectral Research
Technique FT-Raman