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(S)-1-(3-Fluorophenyl)-2-(6-methoxynaphthalen-2-yl)propan-1-one
SpectraBase Compound ID IfuTO0ZwIDc
InChI InChI=1S/C20H17FO2/c1-13(20(22)17-4-3-5-18(21)11-17)14-6-7-16-12-19(23-2)9-8-15(16)10-14/h3-13H,1-2H3/t13-/m0/s1
InChIKey QCSDTJXCPXCYFX-ZDUSSCGKSA-N
Mol Weight 308.35 g/mol
Molecular Formula C20H17FO2
Exact Mass 308.121258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5A2nkuGciZ
Name (S)-1-(3-Fluorophenyl)-2-(6-methoxynaphthalen-2-yl)propan-1-one
Appearance Colorless oil
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Exact Mass 308.121257948 u
Formula C20H17FO2
GC Column OD-H
InChI InChI=1S/C20H17FO2/c1-13(20(22)17-4-3-5-18(21)11-17)14-6-7-16-12-19(23-2)9-8-15(16)10-14/h3-13H,1-2H3/t13-/m0/s1
InChIKey QCSDTJXCPXCYFX-ZDUSSCGKSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102805
Molecular Weight 308.352 g/mol
Optical Rotation [a]D20 = 96 (c = 1.00, CHCl3)
Quality 25
Reported Formula C20H17O2F
SMILES C=1(F)C=C(C=CC1)C([C@@](C)(C1=CC2=C(C=C1)C=C(C=C2)OC)[H])=O
SPLASH splash10-000i-0900000000-944db92594ca31592d38
Sample Comments 99% ee
Source of Spectrum QE-27-SM60-14an (DOI: 10.1002/chem.202102805)
Wiley ID 1902225