For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, 4-(acetyloxy)-3-(methoxycarbonyl)phenyl ester
SpectraBase Compound ID 2jepySlanwa
InChI InChI=1S/C19H18O8/c1-10-7-13(24-3)9-15(21)17(10)19(23)27-12-5-6-16(26-11(2)20)14(8-12)18(22)25-4/h5-9,21H,1-4H3
InChIKey RIYXYSHZXWCWGF-UHFFFAOYSA-N
Mol Weight 374.35 g/mol
Molecular Formula C19H18O8
Exact Mass 374.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6EfbOvYxV8X
Name Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, 4-(acetyloxy)-3-(methoxycarbonyl)phenyl ester
Alternate Name(s) 4'-Acetoxy-3'-methoxycarbonylphenyl 2-hydroxy-4-methoxy-6-methylbenzoate 4-(acetyloxy)-3-(methoxycarbonyl)phenyl 2-hydroxy-4-methoxy-6-methylbenzoate
CAS Registry Number 113487-71-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O8
InChI InChI=1S/C19H18O8/c1-10-7-13(24-3)9-15(21)17(10)19(23)27-12-5-6-16(26-11(2)20)14(8-12)18(22)25-4/h5-9,21H,1-4H3
InChIKey RIYXYSHZXWCWGF-UHFFFAOYSA-N
Molecular Weight 374.345 g/mol
SMILES Oc1c(C(Oc2cc(C(=O)OC)c(cc2)OC(=O)C)=O)c(cc(OC)c1)C
SPLASH splash10-000i-0900000000-8c94002e4dd208d03bc5
Source of Spectrum B-40-1458-15
Wiley ID 1356525