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11-Isopropyl-4,8-dimethyl-14-oxopentadeca-3,7,12-triene-1-nitrile
SpectraBase Compound ID 2DTGNoPmCDu
InChI InChI=1S/C20H31NO/c1-16(2)20(14-12-19(5)22)13-11-18(4)9-6-8-17(3)10-7-15-21/h9-10,12,14,16,20H,6-8,11,13H2,1-5H3/b14-12+,17-10+,18-9+
InChIKey AMTRUTKXCKLTJJ-YKZBDDGOSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqukiTG1NU0
Name 11-Isopropyl-4,8-dimethyl-14-oxopentadeca-3,7,12-triene-1-nitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-16(2)20(14-12-19(5)22)13-11-18(4)9-6-8-17(3)10-7-15-21/h9-10,12,14,16,20H,6-8,11,13H2,1-5H3/b14-12+,17-10+,18-9+
InChIKey AMTRUTKXCKLTJJ-YKZBDDGOSA-N
Molecular Weight 301.474 g/mol
SMILES C(C\C=C\(CC\C=C\(CCC(\C=C\C(C)=O)C(C)C)C)C)#N
SPLASH splash10-0006-9200000000-e79d61cbc0ec0466c41d
Source of Spectrum MN-200-111-7
Synonyms (3E,7E,12E)-11-isopropyl-4,8-dimethyl-14-oxo-3,7,12-pentadecatrienenitrile
Wiley ID 1546430