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HHWWWZQYHPFCBY-UHFFFAOYSA-N
SpectraBase Compound ID CXYHwZUkE40
InChI InChI=1S/C7H6O4/c1-10-7(9)5-2-3-6(8)11-4-5/h2-4H,1H3
InChIKey HHWWWZQYHPFCBY-UHFFFAOYSA-N
Mol Weight 154.12 g/mol
Molecular Formula C7H6O4
Exact Mass 154.026609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMSu4SJgYCa
Name 2H-Pyran-5-carboxylic acid, 2-oxo-, methyl ester
Alternate Name(s) 5-(Carbomethoxy)-2-pyrone 6-ketopyran-3-carboxylic acid methyl ester 6-Oxo-3-pyrancarboxylic acid methyl ester Coumalic acid, methyl ester Glutaconic acid, 4-(hydroxymethylene)-, .delta.-lactone, methyl ester Methyl 2-oxo-2H-pyran-5-carboxylate Methyl 2-pyrone-5-carboxylate Methyl 6-oxidanylidenepyran-3-carboxylate Methyl 6-oxopyran-3-carboxylate Methyl coumalate EINECS 227-871-1 NSC 137387 NSC 34627
CAS Registry Number 6018-41-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6O4
InChI InChI=1S/C7H6O4/c1-10-7(9)5-2-3-6(8)11-4-5/h2-4H,1H3
InChIKey HHWWWZQYHPFCBY-UHFFFAOYSA-N
Molecular Weight 154.121 g/mol
SMILES COC(=O)C=1C=CC(=O)OC1
SPLASH splash10-0g05-9600000000-0d4f44aa357bd437d374
Source of Spectrum W5-1989-26601-1
Wiley ID 1150817