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Methyl (5R)-5-(4-methoxyphenyl)-2-methyl-4,5-dihydrofuran-3-carboxylate
SpectraBase Compound ID 4y0P39miCmZ
InChI InChI=1S/C14H16O4/c1-9-12(14(15)17-3)8-13(18-9)10-4-6-11(16-2)7-5-10/h4-7,13H,8H2,1-3H3/t13-/m1/s1
InChIKey KROHSCPLWQSOCN-CYBMUJFWSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtzpQZzojDp
Name Methyl (5R)-5-(4-methoxyphenyl)-2-methyl-4,5-dihydrofuran-3-carboxylate
Appearance Yellow oil
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Exact Mass 248.104858991 u
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-9-12(14(15)17-3)8-13(18-9)10-4-6-11(16-2)7-5-10/h4-7,13H,8H2,1-3H3/t13-/m1/s1
InChIKey KROHSCPLWQSOCN-CYBMUJFWSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804614
Molecular Weight 248.278 g/mol
Optical Rotation [a]D20 = -156.1 (c = 1.0, CH2Cl2)
Quality 312
Reported Formula C14H16O4
SMILES [C@@]1(OC(=C(C1)C(=O)OC)C)(C1=CC=C(C=C1)OC)[H]
SPLASH splash10-0fr2-1970000000-d81b719af35357800316
Sample Comments er = 5:95
Source of Spectrum ACI-57-SM32-2b (DOI: 10.1002/anie.201804614)
Wiley ID 1893038