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4-HYDROXY-3-(1-HYDROXY-2,2-DIMETHYLPROPYL)-2H-1-BENZOPYRAN-2-ONE
SpectraBase Compound ID 6EwSpGYu6V5
InChI InChI=1S/C14H16O4/c1-14(2,3)12(16)10-11(15)8-6-4-5-7-9(8)18-13(10)17/h4-7,12,15-16H,1-3H3
InChIKey ISJVJSSHSQHWNM-UHFFFAOYSA-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 7TQklYfUR6c
Name 4-Hydroxy-3-(1'-hydroxy-2',2'-dimethylpropyl)-2H-1-benzopyran-2-one
Alternate Name(s) 4-Hydroxy-3-(1-hydroxy-2,2-dimethylpropyl)-2H-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-14(2,3)12(16)10-11(15)8-6-4-5-7-9(8)18-13(10)17/h4-7,12,15-16H,1-3H3
InChIKey ISJVJSSHSQHWNM-UHFFFAOYSA-N
Molecular Weight 248.278 g/mol
SMILES OC1=C(C(C(C)(C)C)O)C(Oc2ccccc12)=O
SPLASH splash10-00xr-0950000000-42220f3baa71e71d7d41
Source of Spectrum H-76-1201-6
Wiley ID 1251095