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2-n-heptadeca-9,12,15-trienyl-4,4-dimethyloxazoline
SpectraBase Compound ID CVX3Hyue8RJ
InChI InChI=1S/C22H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-22(2,3)20-24-21/h4-5,7-8,10-11H,6,9,12-20H2,1-3H3/b5-4+,8-7+,11-10+
InChIKey LWBOPGZOZFWXJK-JSIPCRQOSA-N
Mol Weight 331.5 g/mol
Molecular Formula C22H37NO
Exact Mass 331.287515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMwVgmnrwv8
Name 2-n-heptadeca-9,12,15-trienyl-4,4-dimethyloxazoline
Alternate Name(s) 2-[(9E,12E,15E)-9,12,15-heptadecatrienyl]-4,4-dimethyl-4,5-dihydro-1,3-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H37NO
InChI InChI=1S/C22H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-22(2,3)20-24-21/h4-5,7-8,10-11H,6,9,12-20H2,1-3H3/b5-4+,8-7+,11-10+
InChIKey LWBOPGZOZFWXJK-JSIPCRQOSA-N
Molecular Weight 331.544 g/mol
SMILES C1(=NC(CO1)(C)C)CCCCCCCC\C=C\C\C=C\C\C=C\C
SPLASH splash10-01t9-0921000000-e1a1de0e0bb7e70e033e
Source of Spectrum KO-15-39-3
Wiley ID 1328906