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Benzoic acid, 2-hydroxy-4-methoxy-3-methyl-6-(1-methyl-1-propenyl)-
SpectraBase Compound ID FVEgu5WjcGf
InChI InChI=1S/C13H16O4/c1-5-7(2)9-6-10(17-4)8(3)12(14)11(9)13(15)16/h5-6,14H,1-4H3,(H,15,16)/b7-5-
InChIKey ZIPWUFRYIOVGOD-ALCCZGGFSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwB85W3GUGI
Name Benzoic acid, 2-hydroxy-4-methoxy-3-methyl-6-(1-methyl-1-propenyl)-
CAS Registry Number 117032-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-5-7(2)9-6-10(17-4)8(3)12(14)11(9)13(15)16/h5-6,14H,1-4H3,(H,15,16)/b7-5-
InChIKey ZIPWUFRYIOVGOD-ALCCZGGFSA-N
Molecular Weight 236.267 g/mol
SMILES Oc1c(c(cc(c1C(=O)O)\C(=C/C)C)OC)C
SPLASH splash10-0uy0-0090000000-c0c08eb0ee5ef6e7986c
Source of Spectrum KC-1988-2614-10
Synonyms 2-Hydroxy-4-methoxy-3-methyl-6-[(1Z)-1-methyl-1-propenyl]benzoic acid 40methoxy-3-methyl-6-(1-methylprop-1-enyl)salicylic acid
Wiley ID 1238089