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2-(2-fluoro-3,5-dimethylbenzyl)adamantan-2-ol
SpectraBase Compound ID 7A76o9nW3mY
InChI InChI=1S/C19H25FO/c1-11-3-12(2)18(20)15(4-11)10-19(21)16-6-13-5-14(8-16)9-17(19)7-13/h3-4,13-14,16-17,21H,5-10H2,1-2H3/t13-,14+,16-,17+,19-
InChIKey SYEUVIBUEDFGED-DSSOBMNOSA-N
Mol Weight 288.41 g/mol
Molecular Formula C19H25FO
Exact Mass 288.188944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50z6xeM9xp4
Name 2-(2-fluoro-3,5-dimethylbenzyl)adamantan-2-ol
Appearance Colorless solid
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Formula C19H25FO
InChI InChI=1S/C19H25FO/c1-11-3-12(2)18(20)15(4-11)10-19(21)16-6-13-5-14(8-16)9-17(19)7-13/h3-4,13-14,16-17,21H,5-10H2,1-2H3/t13-,14+,16-,17+,19-
InChIKey SYEUVIBUEDFGED-DSSOBMNOSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202203807
Molecular Weight 288.406 g/mol
Quality 176
Reported Formula C19H25FO
SMILES OC1(CC2=C(F)C(=CC(=C2)C)C)[C@]2(C[C@@]3(C[C@@](C[C@]1(C3)[H])(C2)[H])[H])[H]
SPLASH splash10-0f79-1900000000-48a930c2e87c220838a8
Source of Spectrum ACI-61-SM66-10aj (DOI: 10.1002/anie.202203807)
Wiley ID 1897778