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Azacycloundecane, propanenitrile deriv.
SpectraBase Compound ID 1jpXhN0R043
InChI InChI=1S/C16H29N3O/c17-11-8-12-18-13-9-15-19-14-7-5-3-1-2-4-6-10-16(19)20/h18H,1-10,12-15H2
InChIKey VCPZOHCFVUHZOV-UHFFFAOYSA-N
Mol Weight 279.43 g/mol
Molecular Formula C16H29N3O
Exact Mass 279.231063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DexceC2o7tR
Name Azacycloundecane, propanenitrile deriv.
CAS Registry Number 99014-88-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29N3O
InChI InChI=1S/C16H29N3O/c17-11-8-12-18-13-9-15-19-14-7-5-3-1-2-4-6-10-16(19)20/h18H,1-10,12-15H2
InChIKey VCPZOHCFVUHZOV-UHFFFAOYSA-N
Molecular Weight 279.428 g/mol
SMILES N(CCCN1C(=O)CCCCCCCCC1)CCC#N
SPLASH splash10-0596-9610000000-94f69b8ccf9de75c6584
Source of Spectrum H-68-757-13
Synonyms Propanenitrile, 3-[[3-(2-oxoazacycloundec-1-yl)propyl]amino]- 3-{[3-(2-oxoazacycloundecan-1-yl)propyl]amino}propanenitrile 7-(2-oxo-1-azacycloundec-1-yl)-4-azaheptanenitrile
Wiley ID 1283080