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2,5-Diamino-11H-pyrrolo[2,3-b][1,5]benzodiazepine-3-carbonitrile
SpectraBase Compound ID JxySbxSp4It
InChI InChI=1S/C13H10N6/c14-6-7-5-8-12(16)17-9-3-1-2-4-10(9)18-13(8)19-11(7)15/h1-5H,(H2,16,17)(H3,15,18,19)
InChIKey RFLQRQGZGNVYRH-UHFFFAOYSA-N
Mol Weight 250.27 g/mol
Molecular Formula C13H10N6
Exact Mass 250.096694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMOKdbn6Mdu
Name 2,5-Diamino-11H-pyrrolo[2,3-b][1,5]benzodiazepine-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N6
InChI InChI=1S/C13H10N6/c14-6-7-5-8-12(16)17-9-3-1-2-4-10(9)18-13(8)19-11(7)15/h1-5H,(H2,16,17)(H3,15,18,19)
InChIKey RFLQRQGZGNVYRH-UHFFFAOYSA-N
Molecular Weight 250.265 g/mol
SMILES N1c2c(N=C(c3cc(c(nc13)N)C#N)N)cccc2
SPLASH splash10-004l-2920000000-7cdf529f362f8627902c
Source of Spectrum Y-48-595-13b
Wiley ID 1667696