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N-(2-cyanoethyl)-N-[3-(2-oxoazacyclotridecan-1-yl)propyl]acetamide
SpectraBase Compound ID K5OljO5uCX3
InChI InChI=1S/C20H35N3O2/c1-19(24)22(16-11-14-21)17-12-18-23-15-10-8-6-4-2-3-5-7-9-13-20(23)25/h2-13,15-18H2,1H3
InChIKey IKKBHINLTZRJNA-UHFFFAOYSA-N
Mol Weight 349.5 g/mol
Molecular Formula C20H35N3O2
Exact Mass 349.272927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85hoyW6B7dx
Name N-(2-cyanoethyl)-N-[3-(2-oxoazacyclotridecan-1-yl)propyl]acetamide
CAS Registry Number 67171-83-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H35N3O2
InChI InChI=1S/C20H35N3O2/c1-19(24)22(16-11-14-21)17-12-18-23-15-10-8-6-4-2-3-5-7-9-13-20(23)25/h2-13,15-18H2,1H3
InChIKey IKKBHINLTZRJNA-UHFFFAOYSA-N
Molecular Weight 349.519 g/mol
SMILES C1(N(CCCCCCCCCCC1)CCCN(C(=O)C)CCC#N)=O
SPLASH splash10-008a-2942000000-c1cbcd989a6c8aee9cbd
Source of Spectrum H-61-1349-0
Synonyms N-(2-cyanoethyl)-N-[3-(2-oxo-azacyclotridec-1-yl)propyl]acetamide N-(2-cyanoethyl)-N-[3-(2-oxidanylidene-1-azacyclotridec-1-yl)propyl]ethanamide
Wiley ID 1341433