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[(1S)-2-phenylcyclohex-2-en-1-yl] 2-fluorobenzoate
SpectraBase Compound ID CWXsaYX20eh
InChI InChI=1S/C19H17FO2/c20-17-12-6-4-11-16(17)19(21)22-18-13-7-5-10-15(18)14-8-2-1-3-9-14/h1-4,6,8-12,18H,5,7,13H2/t18-/m0/s1
InChIKey CTCGWJHDKXLWTF-SFHVURJKSA-N
Mol Weight 296.34 g/mol
Molecular Formula C19H17FO2
Exact Mass 296.121258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7XyiuJwk6XN
Name [(1S)-2-phenylcyclohex-2-en-1-yl] 2-fluorobenzoate
Appearance Viscous oil
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Formula C19H17FO2
InChI InChI=1S/C19H17FO2/c20-17-12-6-4-11-16(17)19(21)22-18-13-7-5-10-15(18)14-8-2-1-3-9-14/h1-4,6,8-12,18H,5,7,13H2/t18-/m0/s1
InChIKey CTCGWJHDKXLWTF-SFHVURJKSA-N
Instrument Name Hewlett-Packard 5971
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c01375
Molecular Weight 296.341 g/mol
SMILES c1ccc(cc1)C=1[C@](CCCC1)(OC(c1ccccc1F)=O)[H]
SPLASH splash10-0a4i-1900000000-8159bae3457c2621df93
Source of Spectrum A1-23-SM13-5aj
Wiley ID 1867978