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

*Links on SpectraBase are not permalinks.
1,2-Heptalenedicarboxylic acid, 5,6,8,10-tetramethyl-, 1-methyl ester, (.+-.)-
SpectraBase Compound ID KObvIdt85vh
InChI InChI=1S/C19H20O4/c1-10-8-12(3)15-11(2)6-7-14(18(20)21)17(19(22)23-5)16(15)13(4)9-10/h6-9H,1-5H3,(H,20,21)
InChIKey UJNWDQXSFSLVGK-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C19H20O4
Exact Mass 312.136159 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 7JRhThSdkjm
Name 1,2-Heptalenedicarboxylic acid, 5,6,8,10-tetramethyl-, 1-methyl ester, (.+-.)-
CAS Registry Number 95045-21-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O4
InChI InChI=1S/C19H20O4/c1-10-8-12(3)15-11(2)6-7-14(18(20)21)17(19(22)23-5)16(15)13(4)9-10/h6-9H,1-5H3,(H,20,21)
InChIKey UJNWDQXSFSLVGK-UHFFFAOYSA-N
Molecular Weight 312.365 g/mol
SMILES OC(C=1C(=C2C(=C(C=C(C=C2C)C)C)C(=CC1)C)C(=O)OC)=O
SPLASH splash10-001i-0094000000-2d38262bf37f8a752f29
Source of Spectrum H-68-425-0
Synonyms 1-(methoxycarbonyl)-5,6,8,10-tetramethyl-2-heptalenecarboxylic acid rac-1-methoxycarbonylheptalene-2-carboxylic acid 1-methoxycarbonyl-5,6,8,10-tetramethyl-2-heptalenecarboxylic acid 1-methoxycarbonyl-5,6,8,10-tetramethylheptalene-2-carboxylic acid 1-methoxycarbonyl-5,6,8,10-tetramethyl-heptalene-2-carboxylic acid
Wiley ID 1313503