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1,3,5,7-Cyclooctatetraene, 1-[4-(2,2,2-trifluoroethoxy)butyl]-

View entire compound with spectra: 1 MS (GC)

1,3,5,7-Cyclooctatetraene, 1-[4-(2,2,2-trifluoroethoxy)butyl]-
SpectraBase Compound ID 3T0x5xwkB7u
InChI InChI=1S/C14H17F3O/c15-14(16,17)12-18-11-7-6-10-13-8-4-2-1-3-5-9-13/h1-5,8-9H,6-7,10-12H2/b2-1-,3-1-,4-2-,5-3-,8-4-,9-5-,13-8+,13-9+
InChIKey XUULBDUUHUEDGB-ATKLIFOVSA-N
Mol Weight 258.28 g/mol
Molecular Formula C14H17F3O
Exact Mass 258.12315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5I6nbHo0Ei3
Name 1,3,5,7-Cyclooctatetraene, 1-[4-(2,2,2-trifluoroethoxy)butyl]-
CAS Registry Number 75646-47-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17F3O
InChI InChI=1S/C14H17F3O/c15-14(16,17)12-18-11-7-6-10-13-8-4-2-1-3-5-9-13/h1-5,8-9H,6-7,10-12H2/b2-1-,3-1-,4-2-,5-3-,8-4-,9-5-,13-8+,13-9+
InChIKey XUULBDUUHUEDGB-ATKLIFOVSA-N
Molecular Weight 258.284 g/mol
SMILES C(F)(F)(F)COCCCC\C=1\C=C/C=C\C=C/C/1
SPLASH splash10-014i-0910000000-3090c14117cd2fc24101
Source of Spectrum B-33-1584-0
Synonyms 4-(1,3,5,7-cyclooctatetraenyl)butyl 2,2,2-trifluoroethyl ether 4-Cyclooctatetraenylbutyl 2,2,2-trifluoroethyl ether [4-(2,2,2-trifluoroethoxy)butyl]-1,3,5,7-cyclooctatetraene
Wiley ID 1261669