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Hexan-1-one, 2-ethyl-1-[4-(2-ethylhexanoyl)-[1,4]diazepan-1-yl]-
SpectraBase Compound ID Jz3WvgCpsVX
InChI InChI=1S/C21H40N2O2/c1-5-9-12-18(7-3)20(24)22-14-11-15-23(17-16-22)21(25)19(8-4)13-10-6-2/h18-19H,5-17H2,1-4H3
InChIKey YMTQJGFDZHPMMQ-UHFFFAOYSA-N
Mol Weight 352.6 g/mol
Molecular Formula C21H40N2O2
Exact Mass 352.308979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtZltkXqCcI
Name Hexan-1-one, 2-ethyl-1-[4-(2-ethylhexanoyl)-[1,4]diazepan-1-yl]-
Alternate Name(s) 2-Ethyl-1-[4-(2-ethyl-1-oxohexyl)-1,4-diazepan-1-yl]-1-hexanone 2-Ethyl-1-[4-(2-ethylhexanoyl)-1,4-diazepan-1-yl]hexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40N2O2
InChI InChI=1S/C21H40N2O2/c1-5-9-12-18(7-3)20(24)22-14-11-15-23(17-16-22)21(25)19(8-4)13-10-6-2/h18-19H,5-17H2,1-4H3
InChIKey YMTQJGFDZHPMMQ-UHFFFAOYSA-N
Molecular Weight 352.563 g/mol
SMILES C1N(CCCN(C1)C(C(CCCC)CC)=O)C(C(CCCC)CC)=O
SPLASH splash10-0a4l-9100000000-dc8be35cb7f58808e02f
Wiley ID 1440498