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4-(3-Cyanopyridin-2-yl)-1-piperazinoethanamine
SpectraBase Compound ID 9m0Rf5nitQr
InChI InChI=1S/C12H17N5/c13-3-5-16-6-8-17(9-7-16)12-11(10-14)2-1-4-15-12/h1-2,4H,3,5-9,13H2
InChIKey DOUCVWSOISQWRN-UHFFFAOYSA-N
Mol Weight 231.3 g/mol
Molecular Formula C12H17N5
Exact Mass 231.148396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BE889yLS0uL
Name 4-(3-Cyanopyridin-2-yl)-1-piperazinoethanamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N5
InChI InChI=1S/C12H17N5/c13-3-5-16-6-8-17(9-7-16)12-11(10-14)2-1-4-15-12/h1-2,4H,3,5-9,13H2
InChIKey DOUCVWSOISQWRN-UHFFFAOYSA-N
Instrument Name HP6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1021/jm100925m
Molecular Weight 231.303 g/mol
SMILES NCCN1CCN(c2c(C#N)cccn2)CC1
SPLASH splash10-0udi-0690000000-0fc1a9411047e41a41b6
Source of Spectrum AF-53-7351-18e
Wiley ID 1848640