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3-(Isopropylamino)propionitrile
SpectraBase Compound ID C9E3QarFZst
InChI InChI=1S/C6H12N2/c1-6(2)8-5-3-4-7/h6,8H,3,5H2,1-2H3
InChIKey XBAXAJAODIQLCI-UHFFFAOYSA-N
Mol Weight 112.18 g/mol
Molecular Formula C6H12N2
Exact Mass 112.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnGdcyfpm4V
Name Propanenitrile, 3-[(1-methylethyl)amino]-
CAS Registry Number 692-98-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12N2
InChI InChI=1S/C6H12N2/c1-6(2)8-5-3-4-7/h6,8H,3,5H2,1-2H3
InChIKey XBAXAJAODIQLCI-UHFFFAOYSA-N
Molecular Weight 112.176 g/mol
SMILES N(CCC#N)C(C)C
SPLASH splash10-0a59-9000000000-f98b67c6dd194f7fede3
Source of Spectrum W5-2048-0-0
Synonyms 3-(Isopropylamino)propanenitrile 3-(Isopropylamino)propionitrile 3-(propan-2-ylamino)propanenitrile
Wiley ID 1123246