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8-Fluoro-16-methyl-10-methylsulfanyl[2(2)]metacyclophan-1-ene
SpectraBase Compound ID K0DvmkkZCci
InChI InChI=1S/C18H17FS/c1-12-13-5-4-8-16(12)17(20-2)11-15-7-3-6-14(10-9-13)18(15)19/h3-10,17H,11H2,1-2H3/b10-9-/t17-/m0/s1
InChIKey VAOSLRVLZADBRV-IBSYWUHOSA-N
Mol Weight 284.39 g/mol
Molecular Formula C18H17FS
Exact Mass 284.1035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8O8beV242VI
Name 8-Fluoro-16-methyl-10-methylsulfanyl[2(2)]metacyclophan-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17FS
InChI InChI=1S/C18H17FS/c1-12-13-5-4-8-16(12)17(20-2)11-15-7-3-6-14(10-9-13)18(15)19/h3-10,17H,11H2,1-2H3/b10-9-/t17-/m0/s1
InChIKey VAOSLRVLZADBRV-IBSYWUHOSA-N
Molecular Weight 284.392 g/mol
SMILES c12c(c(\C=C/c3c(c(C[C@@]2(SC)[H])ccc3)F)ccc1)C
SPLASH splash10-0ul9-0090000000-aeb242c5e15c7e561d41
Source of Spectrum KC-0-2364-11
Synonyms (2S)-16-fluoro-15-methyltricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,9,11,13-heptaen-2-yl methyl sulfide (9S)-15-fluoro-16-methyl-9-(methylsulfanyl)tricyclo[9.3.1.1(4,8)]hexadeca-1(15),2,4(16),5,7,11,13-heptaene
Wiley ID 821587