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2-(Phenylthio)ethyl (3r,5r,7r)-adamantane-1-carboxylate
SpectraBase Compound ID 9uNJ2HZPT1r
InChI InChI=1S/C19H24O2S/c20-18(21-6-7-22-17-4-2-1-3-5-17)19-11-14-8-15(12-19)10-16(9-14)13-19/h1-5,14-16H,6-13H2/t14-,15+,16-,19-
InChIKey TYGRZPLVVHQNCN-HGYGSNGRSA-N
Mol Weight 316.46 g/mol
Molecular Formula C19H24O2S
Exact Mass 316.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXkxvaFozXL
Name 2-(Phenylthio)ethyl (3r,5r,7r)-adamantane-1-carboxylate
Appearance Yellow oil
Carrier Gas Argon
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Exact Mass 316.149701185 u
Formula C19H24O2S
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C19H24O2S/c20-18(21-6-7-22-17-4-2-1-3-5-17)19-11-14-8-15(12-19)10-16(9-14)13-19/h1-5,14-16H,6-13H2/t14-,15+,16-,19-
InChIKey TYGRZPLVVHQNCN-HGYGSNGRSA-N
Instrument Name Agilent HP-7890A-AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202211939
Molecular Weight 316.459 g/mol
Quality 210
Reported Formula C19H24O2S
SMILES C1(=CC=CC=C1)SCCOC(=O)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H]
SPLASH splash10-000i-3900000000-46a6887adc136903c4f5
Source of Spectrum ACI-61-SM49-70 (DOI: 10.1002/anie.202211939)
Wiley ID 1899581