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7-Amino-10-nitro-9-(4-nitrophenyl)-1,2,3,4,5,9-hexahydropyrido[1,2-a][1,3]diazepine-8-carbonitrile
SpectraBase Compound ID CUTzKXwMxFm
InChI InChI=1S/C16H16N6O4/c17-9-12-13(10-3-5-11(6-4-10)21(23)24)14(22(25)26)16-19-7-1-2-8-20(16)15(12)18/h3-6,13,19H,1-2,7-8,18H2
InChIKey YCDWGRLRUYDSPV-UHFFFAOYSA-N
Mol Weight 356.34 g/mol
Molecular Formula C16H16N6O4
Exact Mass 356.123303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVmfhW6lu55
Name 7-Amino-10-nitro-9-(4-nitrophenyl)-1,2,3,4,5,9-hexahydropyrido[1,2-a][1,3]diazepine-8-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N6O4
InChI InChI=1S/C16H16N6O4/c17-9-12-13(10-3-5-11(6-4-10)21(23)24)14(22(25)26)16-19-7-1-2-8-20(16)15(12)18/h3-6,13,19H,1-2,7-8,18H2
InChIKey YCDWGRLRUYDSPV-UHFFFAOYSA-N
Molecular Weight 356.342 g/mol
SMILES N1CCCCN2C1=C(C(C(=C2N)C#N)c1ccc(N(=O)=O)cc1)N(=O)=O
SPLASH splash10-053s-9520000000-f21811012da5dfa34c78
Source of Spectrum Y-50-679-5g
Synonyms 7-Azanyl-10-nitro-9-(4-nitrophenyl)-1,2,3,4,5,9-hexahydropyrido[1,2-a][1,3]diazepine-8-carbonitrile
Wiley ID 1736540