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Propanenitrile, 3-[[3-(2-oxoazacyclotridec-1-yl)propyl]amino]-
SpectraBase Compound ID Bmr7stOoEVo
InChI InChI=1S/C18H33N3O/c19-13-10-14-20-15-11-17-21-16-9-7-5-3-1-2-4-6-8-12-18(21)22/h20H,1-12,14-17H2
InChIKey RYYOEHQJTASFLE-UHFFFAOYSA-N
Mol Weight 307.5 g/mol
Molecular Formula C18H33N3O
Exact Mass 307.262363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6whtZt6lvZq
Name Propanenitrile, 3-[[3-(2-oxoazacyclotridec-1-yl)propyl]amino]-
Alternate Name(s) (3-(6-cyano-4-azahexyl)-12-dodecanlactam (3-(6-cyano-4-azahexyl)-12-dodecanolactam 3-{[3-(2-oxoazacyclotridecan-1-yl)propyl]amino}propanenitrile Azacyclotridecane, propanenitrile deriv.
CAS Registry Number 67171-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H33N3O
InChI InChI=1S/C18H33N3O/c19-13-10-14-20-15-11-17-21-16-9-7-5-3-1-2-4-6-8-12-18(21)22/h20H,1-12,14-17H2
InChIKey RYYOEHQJTASFLE-UHFFFAOYSA-N
Molecular Weight 307.482 g/mol
SMILES N(CCCN1C(=O)CCCCCCCCCCC1)CCC#N
SPLASH splash10-0230-9641000000-4fc750db7a3d98d755ad
Source of Spectrum H-61-1349-0
Wiley ID 1309082