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2-N-Heptadeca-9,12,15-trienyl-4,4-dimethyloxazoline

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxvdZcHXgfY
Name 2-N-Heptadeca-9,12,15-trienyl-4,4-dimethyloxazoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.287514814 u
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