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Brotizolam

View entire compound with spectra: 1 NMR, 2 FTIR, 1 Raman, and 8 MS (GC)

Brotizolam
SpectraBase Compound ID IWGFNoBjPJD
InChI InChI=1S/C15H10BrClN4S/c1-8-19-20-13-7-18-14(9-4-2-3-5-11(9)17)10-6-12(16)22-15(10)21(8)13/h2-6H,7H2,1H3
InChIKey UMSGKTJDUHERQW-UHFFFAOYSA-N
Mol Weight 393.69 g/mol
Molecular Formula C15H10BrClN4S
Exact Mass 391.949808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IGyC7s1xrDc
Name BROTIZOLAM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H10BrClN4S
InChI InChI=1S/C15H10BrClN4S/c1-8-19-20-13-7-18-14(9-4-2-3-5-11(9)17)10-6-12(16)22-15(10)21(8)13/h2-6H,7H2,1H3
InChIKey UMSGKTJDUHERQW-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 393.690 g/mol
SMILES c1c(Br)sc2-[n]3c(C)nnc3CN=C(c3ccccc3Cl)c12
SPLASH splash10-0006-4849000000-2498b0c4a8e4e9e08642
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany