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ethyl (2R,3S)-2,3-dimethyl-4-phenyl-butanoate
SpectraBase Compound ID HymxCRssZS2
InChI InChI=1S/C14H20O2/c1-4-16-14(15)12(3)11(2)10-13-8-6-5-7-9-13/h5-9,11-12H,4,10H2,1-3H3/t11-,12+/m0/s1
InChIKey WVSGGPDIILXWDW-NWDGAFQWSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z6NEHBIKkW
Name ethyl (2R,3S)-2,3-dimethyl-4-phenyl-butanoate
Appearance Colorless oil
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Exact Mass 220.146329882 u
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-4-16-14(15)12(3)11(2)10-13-8-6-5-7-9-13/h5-9,11-12H,4,10H2,1-3H3/t11-,12+/m0/s1
InChIKey WVSGGPDIILXWDW-NWDGAFQWSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601911
Molecular Weight 220.312 g/mol
Quality 188
Reported Formula C14H20O2
SMILES C1(C[C@@]([C@](C(OCC)=O)(C)[H])(C)[H])=CC=CC=C1
SPLASH splash10-0udl-8900000000-9d2db6536ae1dc1876fc
Sample Comments dr = 9:91
Source of Spectrum QE-22-SM34-syn-1a (DOI: 10.1002/chem.201601911)
Wiley ID 1903524