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Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
SpectraBase Compound ID G7VrIluuQSu
InChI InChI=1S/C12H21N3O/c13-7-4-8-14-9-5-11-15-10-3-1-2-6-12(15)16/h14H,1-6,8-11H2
InChIKey VWQURGLLEXLMCX-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C12H21N3O
Exact Mass 223.168462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Exa6AEh9FWt
Name Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
Alternate Name(s) 3-([3-(2-Oxo-1-azepanyl)propyl]amino)propanenitrile 3-[3-(2-ketoazepan-1-yl)propylamino]propionitrile 3-[3-(2-oxidanylideneazepan-1-yl)propylamino]propanenitrile 3-[3-(2-oxoazepan-1-yl)propylamino]propanenitrile N-(6-Cyano-4-azahexyl)-.epsilon.-caprolactam
CAS Registry Number 67370-63-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21N3O
InChI InChI=1S/C12H21N3O/c13-7-4-8-14-9-5-11-15-10-3-1-2-6-12(15)16/h14H,1-6,8-11H2
InChIKey VWQURGLLEXLMCX-UHFFFAOYSA-N
Molecular Weight 223.320 g/mol
SMILES N(CCCN1C(=O)CCCCC1)CCC#N
SPLASH splash10-00b9-3900000000-065699490be86cc39b68
Source of Spectrum H-61-1058-0
Wiley ID 1224028