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((3S,4R)-4-Hydroxy-chroman-3-yl)-acetic acid methyl ester
SpectraBase Compound ID 37J4DRGaAMx
InChI InChI=1S/C12H14O4/c1-15-11(13)6-8-7-16-10-5-3-2-4-9(10)12(8)14/h2-5,8,12,14H,6-7H2,1H3/t8-,12+/m0/s1
InChIKey WAKASRHWANVAOF-QPUJVOFHSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpTGOp1So0u
Name ((3S,4R)-4-Hydroxy-chroman-3-yl)-acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-15-11(13)6-8-7-16-10-5-3-2-4-9(10)12(8)14/h2-5,8,12,14H,6-7H2,1H3/t8-,12+/m0/s1
InChIKey WAKASRHWANVAOF-QPUJVOFHSA-N
Molecular Weight 222.240 g/mol
SMILES O[C@@]1([C@@](CC(=O)OC)(COc2c1cccc2)[H])[H]
SPLASH splash10-008d-2900000000-cd18e0f8026016a64267
Source of Spectrum K-2002-1466-16
Synonyms (3R*,4S)-Methyl 4-hydroxy-3,4-dihydro-2H-chromen-3-yl acetate Methyl[(3S,4R)-4-hydroxy-3,4-dihydro-2H-chromen-3-yl]acetate 2-[(3S,4R)-4-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl]acetic acid methyl ester Methyl 2-[(3S,4R)-4-hydroxy-3,4-dihydro-2H-chromen-3-yl]acetate Methyl 2-[(3S,4R)-4-hydroxychroman-3-yl]acetate Methyl 2-[(3S,4R)-4-oxidanyl-3,4-dihydro-2H-chromen-3-yl]ethanoate
Wiley ID 1581284