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5-Acetoxyevernic Acid
SpectraBase Compound ID 8VGJ1gUM4Uy
InChI InChI=1S/C19H18O9/c1-8-5-11(6-12(21)15(8)18(23)24)28-19(25)16-9(2)17(27-10(3)20)14(26-4)7-13(16)22/h5-7,21-22H,1-4H3,(H,23,24)
InChIKey IOYKYAJNVPQFFB-UHFFFAOYSA-N
Mol Weight 390.34 g/mol
Molecular Formula C19H18O9
Exact Mass 390.095082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52ORg3Wde4
Name 5-Acetoxyevernic Acid
Alternate Name(s) 4-{[3-(acetyloxy)-2-hydroxy-4-methoxy-6-methylbenzoyl]oxy}-2-hydroxy-6-methylbenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O9
InChI InChI=1S/C19H18O9/c1-8-5-11(6-12(21)15(8)18(23)24)28-19(25)16-9(2)17(27-10(3)20)14(26-4)7-13(16)22/h5-7,21-22H,1-4H3,(H,23,24)
InChIKey IOYKYAJNVPQFFB-UHFFFAOYSA-N
Molecular Weight 390.344 g/mol
SMILES Oc1cc(cc(c1C(=O)O)C)OC(c1c(c(OC(=O)C)c(cc1O)OC)C)=O
SPLASH splash10-000x-4900000000-d69828a1d8765b0f55be
Source of Spectrum B-44-157-0
Wiley ID 1364658