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

*Links on SpectraBase are not permalinks.
1,3-Azulenedicarboxylic acid, 2,4,5,6,7,8-hexahydro-, dimethyl ester
SpectraBase Compound ID 6oRHTN67AZZ
InChI InChI=1S/C14H18O4/c1-17-13(15)11-8-12(14(16)18-2)10-7-5-3-4-6-9(10)11/h3-8H2,1-2H3
InChIKey KZDCLQYODSFDBT-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 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 IJG6nOA6ztK
Name 1,3-Azulenedicarboxylic acid, 2,4,5,6,7,8-hexahydro-, dimethyl ester
CAS Registry Number 99081-98-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-17-13(15)11-8-12(14(16)18-2)10-7-5-3-4-6-9(10)11/h3-8H2,1-2H3
InChIKey KZDCLQYODSFDBT-UHFFFAOYSA-N
Molecular Weight 250.294 g/mol
SMILES C1(=C2C(CCCCC2)=C(C1)C(=O)OC)C(=O)OC
SPLASH splash10-0gb9-0090000000-870a9094b448808ed59c
Source of Spectrum K-118-3293-6
Synonyms Bicyclo[5.3.0]deca-1(10),7-dien-8,10-dicarbonsaure-dimethylester dimethyl 2,4,5,6,7,8-hexahydro-1,3-azulenedicarboxylate
Wiley ID 1253346