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4-Benzyloxy-5'-trifluoromethylcyclohexanespiro-4'-(1',3'-dioxolane)-2'-thione

View entire compound with spectra: 2 MS (GC)

4-Benzyloxy-5'-trifluoromethylcyclohexanespiro-4'-(1',3'-dioxolane)-2'-thione
SpectraBase Compound ID Aes5N9HT3sw
InChI InChI=1S/C16H17F3O3S/c17-16(18,19)13-15(22-14(23)21-13)8-6-12(7-9-15)20-10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
InChIKey AXSYIGBLJLHIKL-UHFFFAOYSA-N
Mol Weight 346.36 g/mol
Molecular Formula C16H17F3O3S
Exact Mass 346.08505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JefWK1Nulpm
Name 4-Benzyloxy-5'-trifluoromethylcyclohexanespiro-4'-(1',3'-dioxolane)-2'-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3O3S
InChI InChI=1S/C16H17F3O3S/c17-16(18,19)13-15(22-14(23)21-13)8-6-12(7-9-15)20-10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
InChIKey AXSYIGBLJLHIKL-UHFFFAOYSA-N
Molecular Weight 346.364 g/mol
SMILES C1(C2(OC(O1)=S)CCC(OCc1ccccc1)CC2)C(F)(F)F
SPLASH splash10-0006-9000000000-489aabc8c50fcbc3e0ef
Source of Spectrum E1-45-46-14
Wiley ID 1553637