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1H-Azepine, hexahydro-1-(1-oxo-9-octadecenyl)-
SpectraBase Compound ID EW7T4gxTKTg
InChI InChI=1S/C24H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24(26)25-22-19-16-17-20-23-25/h9-10H,2-8,11-23H2,1H3/b10-9+
InChIKey VADPGEGXKQJSBO-MDZDMXLPSA-N
Mol Weight 363.6 g/mol
Molecular Formula C24H45NO
Exact Mass 363.350115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CuvSMij6FsG
Name 1H-Azepine, hexahydro-1-(1-oxo-9-octadecenyl)-
Alternate Name(s) 1-[(9E)-9-Octadecenoyl]azepane (E)-1-(1-azepanyl)-9-octadecen-1-one (E)-1-(azepan-1-yl)octadec-9-en-1-one
CAS Registry Number 56630-43-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H45NO
InChI InChI=1S/C24H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24(26)25-22-19-16-17-20-23-25/h9-10H,2-8,11-23H2,1H3/b10-9+
InChIKey VADPGEGXKQJSBO-MDZDMXLPSA-N
Molecular Weight 363.630 g/mol
SMILES C(CCCCCCC(=O)N1CCCCCC1)\C=C\CCCCCCCC
SPLASH splash10-0k96-9821000000-503e3abd57a00ad2b516
Source of Spectrum EP-5475-0-0
Wiley ID 1350381