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(5Z,8Z,11Z,14Z,17Z,20Z)-1,1,1-trifluoro-2-tricosa-5,8,11,14,17,20-hexaenone

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(5Z,8Z,11Z,14Z,17Z,20Z)-1,1,1-trifluoro-2-tricosa-5,8,11,14,17,20-hexaenone
SpectraBase Compound ID ENx698uzCaB
InChI InChI=1S/C23H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(27)23(24,25)26/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey SYODIJOEBOGRSG-KUBAVDMBSA-N
Mol Weight 380.5 g/mol
Molecular Formula C23H31F3O
Exact Mass 380.2327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7SmpNgf0nD
Name (5Z,8Z,11Z,14Z,17Z,20Z)-1,1,1-Trifluoro-2-tricosa-5,8,11,14,17,20-hexaenone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.232700106 u
Formula C23H31F3O
InChI InChI=1S/C23H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(27)23(24,25)26/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey SYODIJOEBOGRSG-KUBAVDMBSA-N
Molecular Weight 380.495 g/mol
SMILES C(C(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)(F)(F)F