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2-[(2S,4R,5R)-5-(2-chloro-5-methoxy-phenyl)-2-methyl-1,3-dioxolan-4-yl]acetic acid methyl ester

View entire compound with spectra: 1 MS (GC)

2-[(2S,4R,5R)-5-(2-chloro-5-methoxy-phenyl)-2-methyl-1,3-dioxolan-4-yl]acetic acid methyl ester
SpectraBase Compound ID 5cSS0R1lah6
InChI InChI=1S/C14H17ClO5/c1-8-19-12(7-13(16)18-3)14(20-8)10-6-9(17-2)4-5-11(10)15/h4-6,8,12,14H,7H2,1-3H3/t8-,12+,14+/m0/s1
InChIKey QFOUGDFAFZOXHI-REAQECSSSA-N
Mol Weight 300.74 g/mol
Molecular Formula C14H17ClO5
Exact Mass 300.076451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNBkvGNbHQC
Name 2-[(2S,4R,5R)-5-(2-chloro-5-methoxy-phenyl)-2-methyl-1,3-dioxolan-4-yl]acetic acid methyl ester
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Formula C14H17ClO5
InChI InChI=1S/C14H17ClO5/c1-8-19-12(7-13(16)18-3)14(20-8)10-6-9(17-2)4-5-11(10)15/h4-6,8,12,14H,7H2,1-3H3/t8-,12+,14+/m0/s1
InChIKey QFOUGDFAFZOXHI-REAQECSSSA-N
Molecular Weight 300.738 g/mol
SMILES [C@]1(c2c(ccc(c2)OC)Cl)([C@](O[C@@](O1)(C)[H])(CC(=O)OC)[H])[H]
SPLASH splash10-0aor-6940000000-38a1be2a89e5c66f2f64
Source of Spectrum KC-0-3954-6
Synonyms Methyl 2-[(2S,4R,5R)-5-(2-chloranyl-5-methoxy-phenyl)-2-methyl-1,3-dioxolan-4-yl]ethanoate Methyl 2-[(2S,4R,5R)-5-(2-chloro-5-methoxy-phenyl)-2-methyl-1,3-dioxolan-4-yl]acetate 2-[(2S,4R,5R)-5-(2-chloro-5-methoxyphenyl)-2-methyl-1,3-dioxolan-4-yl]acetic acid methyl ester
Wiley ID 827114