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(S)-1,1,1-trifluorohexadecan-2-ol
SpectraBase Compound ID GbAWb88Ph2L
InChI InChI=1S/C16H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(20)16(17,18)19/h15,20H,2-14H2,1H3/t15-/m0/s1
InChIKey OZBPKKPBNFXTPE-HNNXBMFYSA-N
Mol Weight 296.42 g/mol
Molecular Formula C16H31F3O
Exact Mass 296.2327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rlcv6PcAxt
Name (S)-1,1,1-trifluorohexadecan-2-ol
Appearance Pale-yellow solid
Carrier Gas Helium
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Exact Mass 296.232700106 u
Formula C16H31F3O
InChI InChI=1S/C16H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(20)16(17,18)19/h15,20H,2-14H2,1H3/t15-/m0/s1
InChIKey OZBPKKPBNFXTPE-HNNXBMFYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202059
Molecular Weight 296.418 g/mol
Optical Rotation [a]D25 = -14.8 (c = 0.25, CHCl3)
Quality 28
SMILES O[C@](C(F)(F)F)(CCCCCCCCCCCCCC)[H]
SPLASH splash10-0002-0930000000-5c91eeedfd991780f5b2
Source of Spectrum QE-28-SM32-8c (DOI: 10.1002/chem.202202059)
Wiley ID 1900722