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Phosphonic acid, [1-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-methyl-2-butenyl]-, dimethyl ester
SpectraBase Compound ID EHqmIPYNMVa
InChI InChI=1S/C16H19O6P/c1-10(2)9-13(23(19,20-3)21-4)14-15(17)11-7-5-6-8-12(11)22-16(14)18/h5-9,13,17H,1-4H3
InChIKey XRSVDHUFQQAJAR-UHFFFAOYSA-N
Mol Weight 338.3 g/mol
Molecular Formula C16H19O6P
Exact Mass 338.091925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmW203R1ng4
Name Phosphonic acid, [1-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-methyl-2-butenyl]-, dimethyl ester
Alternate Name(s) Dimethyl 1-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-methyl-2-butenylphosphonate Dimethyl[1-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-methylbut-2-enyl]phosphonate
CAS Registry Number 132356-64-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19O6P
InChI InChI=1S/C16H19O6P/c1-10(2)9-13(23(19,20-3)21-4)14-15(17)11-7-5-6-8-12(11)22-16(14)18/h5-9,13,17H,1-4H3
InChIKey XRSVDHUFQQAJAR-UHFFFAOYSA-N
Molecular Weight 338.296 g/mol
SMILES OC1=C(C(Oc2ccccc12)=O)C(P(=O)(OC)OC)C=C(C)C
SPLASH splash10-02k9-2292000000-55161868def1d6eb4d53
Source of Spectrum H-73-1877-12
Wiley ID 1333516