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2H-Pyran-2-one, 6-(2-fluoro-1,3,6,9-pentadecatetraenyl)tetrahydro-
SpectraBase Compound ID 2qgWoxzMhjs
InChI InChI=1S/C20H29FO2/c1-2-3-4-5-6-7-8-9-10-11-12-14-18(21)17-19-15-13-16-20(22)23-19/h6-7,9-10,12,14,17,19H,2-5,8,11,13,15-16H2,1H3/b7-6+,10-9+,14-12-,18-17+
InChIKey LYLFVODLRHBCTF-YWFPEMIASA-N
Mol Weight 320.45 g/mol
Molecular Formula C20H29FO2
Exact Mass 320.215158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TkuHsQkRlx
Name 2H-Pyran-2-one, 6-(2-fluoro-1,3,6,9-pentadecatetraenyl)tetrahydro-
Alternate Name(s) (Z,Z,Z)-8-vinyl-7,7-difluorooctadeca-5,9,12-trienoic acid 6-[(1E,3Z,6E,9E)-2-fluoro-1,3,6,9-pentadecatetraenyl]tetrahydro-2H-pyran-2-one
CAS Registry Number 108235-05-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29FO2
InChI InChI=1S/C20H29FO2/c1-2-3-4-5-6-7-8-9-10-11-12-14-18(21)17-19-15-13-16-20(22)23-19/h6-7,9-10,12,14,17,19H,2-5,8,11,13,15-16H2,1H3/b7-6+,10-9+,14-12-,18-17+
InChIKey LYLFVODLRHBCTF-YWFPEMIASA-N
Molecular Weight 320.448 g/mol
SMILES C(\C=C/C(=C\C1OC(=O)CCC1)F)\C=C\C\C=C\CCCCC
SPLASH splash10-004i-0903000000-d32c2229d1c2db142430
Source of Spectrum C-109-3691-25
Wiley ID 1320381