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Alprazelam-d8
SpectraBase Compound ID 43CFYRo3sQv
InChI InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3/i1D3,2D,3D,4D,5D,6D
InChIKey VREFGVBLTWBCJP-JGUCLWPXSA-N
Mol Weight 316.82 g/mol
Molecular Formula C17H52D8ClN4
Exact Mass 316.133088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aN0ikQ7WaS
Name Alprazolam-d8
Alternate Name(s) 8-Chloro-1-(methyl-d3)-6-(phenyl-d5)-4H-benzo[f][1,2,4]triazolo[4,3-a][1,4]diazepine
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Formula C17H5D8ClN4
InChI InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3/i1D3,2D,3D,4D,5D,6D
InChIKey VREFGVBLTWBCJP-JGUCLWPXSA-N
Molecular Weight 316.821 g/mol
SMILES c12c(ccc(c2)Cl)-[n]2c(CN=C1c1c(c(c(c(c1[2D])[2D])[2D])[2D])[2D])nnc2C([2D])([2D])[2D]
SPLASH splash10-05n0-3692000000-1da14c3f1e86004d28bf
Source of Spectrum SWG-33-4309-0
Wiley ID 1810926