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3-Amino-5-(4-aminobutyl)-1H-pyrazole-4-carbonitrile
SpectraBase Compound ID Jg8KKgDHaaq
InChI InChI=1S/C8H13N5/c9-4-2-1-3-7-6(5-10)8(11)13-12-7/h1-4,9H2,(H3,11,12,13)
InChIKey QYCWRARKRFYENK-UHFFFAOYSA-N
Mol Weight 179.23 g/mol
Molecular Formula C8H13N5
Exact Mass 179.117095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MqnWhhZ7BS
Name 3-Amino-5-(4-aminobutyl)-1H-pyrazole-4-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N5
InChI InChI=1S/C8H13N5/c9-4-2-1-3-7-6(5-10)8(11)13-12-7/h1-4,9H2,(H3,11,12,13)
InChIKey QYCWRARKRFYENK-UHFFFAOYSA-N
Molecular Weight 179.227 g/mol
SMILES [nH]1nc(c(c1N)C#N)CCCCN
SPLASH splash10-00fs-3900000000-60707eb7de21e8ea5ac3
Source of Spectrum Y-28-1258-6
Synonyms 3-Azanyl-5-(4-azanylbutyl)-1H-pyrazole-4-carbonitrile 5-Amino-3-(4-aminobutyl)-1H-pyrazole-4-carbonitrile
Wiley ID 1175056