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(S)-(+)-3-(2-HYDROXYBUTYL)-1-H-2-BENZOPYRAN-1-ONE;(+)-2'-HYDROXY-DIHYDROARTEMIDIN
SpectraBase Compound ID JAgAqh0hfPG
InChI InChI=1S/C13H14O3/c1-2-10(14)8-11-7-9-5-3-4-6-12(9)13(15)16-11/h3-7,10,14H,2,8H2,1H3/t10-/m0/s1
InChIKey LVRJXZKFLHMXRP-JTQLQIEISA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dxLTqCogsu
Name 3-[(2S)-2-hydroxybutyl]-2-benzopyran-1-one
Alternate Name(s) 3-[(2S)-2-hydroxybutyl]isochromen-1-one 3-[(2S)-2-hydroxybutyl]isocoumarin 3-[(2S)-2-oxidanylbutyl]isochromen-1-one
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Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-2-10(14)8-11-7-9-5-3-4-6-12(9)13(15)16-11/h3-7,10,14H,2,8H2,1H3/t10-/m0/s1
InChIKey LVRJXZKFLHMXRP-JTQLQIEISA-N
Molecular Weight 218.252 g/mol
SMILES O[C@](CC=1OC(c2c(C1)cccc2)=O)(CC)[H]
SPLASH splash10-03dr-4900000000-66b577d42771dcef4035
Source of Spectrum AH-134-1203-9
Wiley ID 1546944