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(S)-1-(3-fluoro-4-methoxyphenyl)propan-2-ol
SpectraBase Compound ID 42aqbvpZloa
InChI InChI=1S/C10H13FO2/c1-7(12)5-8-3-4-10(13-2)9(11)6-8/h3-4,6-7,12H,5H2,1-2H3/t7-/m0/s1
InChIKey YTTNKKSBKRTECH-ZETCQYMHSA-N
Mol Weight 184.21 g/mol
Molecular Formula C10H13FO2
Exact Mass 184.089958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9z0DCoDbNxg
Name (S)-1-(3-fluoro-4-methoxyphenyl)propan-2-ol
Appearance Colorless oil
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Exact Mass 184.089957820 u
Formula C10H13FO2
InChI InChI=1S/C10H13FO2/c1-7(12)5-8-3-4-10(13-2)9(11)6-8/h3-4,6-7,12H,5H2,1-2H3/t7-/m0/s1
InChIKey YTTNKKSBKRTECH-ZETCQYMHSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202214377
Molecular Weight 184.210 g/mol
Optical Rotation [a]D20 = +18.4 (c = 1.06, CHCl3)
Quality 187
Reported Formula C10H13FO2
SMILES O[C@](CC1=CC(F)=C(C=C1)OC)(C)[H]
SPLASH splash10-002o-1900000000-941b011e5b627426ede4
Source of Spectrum ACI-62-SM22-(S)-7e (DOI: 10.1002/anie.202214377)
Wiley ID 1908253