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methyl threo 2,3-difluoro-3-phenylpropionate
SpectraBase Compound ID 3TjQX3v2DEd
InChI InChI=1S/C10H10F2O2/c1-14-10(13)9(12)8(11)7-5-3-2-4-6-7/h2-6,8-9H,1H3/t8-,9+/m1/s1
InChIKey HERRUYCKDXHMOI-BDAKNGLRSA-N
Mol Weight 200.18 g/mol
Molecular Formula C10H10F2O2
Exact Mass 200.064886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kr5dU9vv1KW
Name methyl threo 2,3-difluoro-3-phenylpropionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.064885886 u
Formula C10H10F2O2
InChI InChI=1S/C10H10F2O2/c1-14-10(13)9(12)8(11)7-5-3-2-4-6-7/h2-6,8-9H,1H3/t8-,9+/m1/s1
InChIKey HERRUYCKDXHMOI-BDAKNGLRSA-N
Instrument Name Agilent 6890-5973N
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-2-19
Molecular Weight 200.185 g/mol
Quality 115
SMILES C1=CC(=CC=C1)[C@@](F)([C@@](C(=O)OC)(F)[H])[H]
SPLASH splash10-0a4i-0900000000-06079e15a5a4a9d05796
Source of Spectrum BJO-2-SM6-21 (DOI: 10.1186/1860-5397-2-19)
Wiley ID 1908944