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Brotizolam-M (Hydroxymethyl)

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Brotizolam-M (Hydroxymethyl)
SpectraBase Compound ID 8bDVLrx45Gc
InChI InChI=1S/C15H10BrClN4OS/c16-11-5-9-14(8-3-1-2-4-10(8)17)18-6-12-19-20-13(7-22)21(12)15(9)23-11/h1-5,22H,6-7H2
InChIKey SCENUYIFDLIXIB-UHFFFAOYSA-N
Mol Weight 409.69 g/mol
Molecular Formula C15H10BrClN4OS
Exact Mass 407.944723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrvrG9t2yz5
Name 2-Bromo-4-(o-chlorophenyl)-9-(hydroxymethyl)-6H-thieno[3,2-f](1,2,4)triazolo[4,3-a](1,4)diazepine
Alternate Name(s) .alpha.-hydroxy-brotizolam derivative [2-bromo-4-(2-chlorophenyl)-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-9-yl]methanol
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Formula C15H10BrClN4OS
InChI InChI=1S/C15H10BrClN4OS/c16-11-5-9-14(8-3-1-2-4-10(8)17)18-6-12-19-20-13(7-22)21(12)15(9)23-11/h1-5,22H,6-7H2
InChIKey SCENUYIFDLIXIB-UHFFFAOYSA-N
Molecular Weight 409.689 g/mol
SMILES OCc1[n]2-c3c(C(=NCc2nn1)c1c(Cl)cccc1)cc(s3)Br
SPLASH splash10-08fr-0001900000-131ea9b0c52ef06e27c6
Source of Spectrum CJ-0-48-0
Wiley ID 1372723