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Benzoic acid, 3-formyl-4,6-dihydroxy-2,5-dimethyl-, methyl ester
SpectraBase Compound ID 365kmvVA4SK
InChI InChI=1S/C11H12O5/c1-5-7(4-12)9(13)6(2)10(14)8(5)11(15)16-3/h4,13-14H,1-3H3
InChIKey STPHTBJNRRRPNU-UHFFFAOYSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Z2N7aZOUe9
Name Benzoic acid, 3-formyl-4,6-dihydroxy-2,5-dimethyl-, methyl ester
Alternate Name(s) Methyl 3-formyl-4,6-dihydroxy-2,5-dimethylbenzoate 5-formyl-2,4-dihydroxy-3,6-dimethyl-benzoic acid methyl ester Methyl 3-methanoyl-2,5-dimethyl-4,6-bis(oxidanyl)benzoate Methyl 5-formyl-2,4-dihydroxy-3,6-dimethyl-benzoate 5-formyl-2,4-dihydroxy-3,6-dimethylbenzoic acid methyl ester
CAS Registry Number 34874-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c1-5-7(4-12)9(13)6(2)10(14)8(5)11(15)16-3/h4,13-14H,1-3H3
InChIKey STPHTBJNRRRPNU-UHFFFAOYSA-N
Molecular Weight 224.212 g/mol
SMILES Oc1c(c(c(c(c1C(=O)OC)C)C=O)O)C
SPLASH splash10-0imr-9400000000-2ae037e7286782a38618
Source of Spectrum AD-0-5966-0
Wiley ID 29378