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ethyl (2S,3R)-4-benzyloxy-2,3-dimethyl-butanoate
SpectraBase Compound ID JNKHk9mBcPK
InChI InChI=1S/C15H22O3/c1-4-18-15(16)13(3)12(2)10-17-11-14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3/t12-,13-/m0/s1
InChIKey HEFOZGONHFKBEU-STQMWFEESA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4c2HKKjkfcf
Name ethyl (2S,3R)-4-benzyloxy-2,3-dimethyl-butanoate
Appearance Colorless oil
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Exact Mass 250.156894565 u
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-4-18-15(16)13(3)12(2)10-17-11-14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3/t12-,13-/m0/s1
InChIKey HEFOZGONHFKBEU-STQMWFEESA-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 250.338 g/mol
Quality 113
Reported Formula C15H22O3
SMILES C([C@@]([C@@](C(OCC)=O)(C)[H])(C)[H])OCC1=CC=CC=C1
SPLASH splash10-0f6x-9600000000-621db7be527d03232520
Sample Comments dr = 91:9
Source of Spectrum QE-22-SM40-anti-1e (DOI: 10.1002/chem.201601911)
Wiley ID 1903500