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8-Chloranyl-5-methyl-3-pentanoyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
SpectraBase Compound ID AaQ2cSj0Ilf
InChI InChI=1S/C17H18ClN3O2/c1-3-4-5-15(22)16-14-9-20(2)17(23)12-8-11(18)6-7-13(12)21(14)10-19-16/h6-8,10H,3-5,9H2,1-2H3
InChIKey NYHQSWXKALTJCU-UHFFFAOYSA-N
Mol Weight 331.8 g/mol
Molecular Formula C17H18ClN3O2
Exact Mass 331.108755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YnjeuuuHa8
Name 8-Chloranyl-5-methyl-3-pentanoyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClN3O2
InChI InChI=1S/C17H18ClN3O2/c1-3-4-5-15(22)16-14-9-20(2)17(23)12-8-11(18)6-7-13(12)21(14)10-19-16/h6-8,10H,3-5,9H2,1-2H3
InChIKey NYHQSWXKALTJCU-UHFFFAOYSA-N
Molecular Weight 331.803 g/mol
SMILES C(=O)(c1c2[n](-c3c(C(N(C2)C)=O)cc(cc3)Cl)cn1)CCCC
SPLASH splash10-001i-0059000000-1337bb994d4622332cee
Source of Spectrum E1-38-1686-9
Synonyms 8-Chloro-5-methyl-3-(1-oxopentyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one 8-Chloro-5-methyl-3-pentanoyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one 8-Chloro-5-methyl-3-valeryl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
Wiley ID 1598326