Dataset

CAMPHORIC ACID DIMETHYL ESTER

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP002226 contains the MS mass spectrum of CAMPHORIC ACID DIMETHYL ESTER with the InChIkey JTQKJWYDOXYYBH-PELKAZGASA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H20O4/c1-11(2)8(9(13)15-4)6-7-12(11,3)10(14)16-5/h8H,6-7H2,1-5H3/t8-,12+/m1/s1
SMILES COC(=O)C([H])(C1)C(C)(C)C(C)(C1)C(=O)OC
InChI Key JTQKJWYDOXYYBH-PELKAZGASA-N
Molecular Formula C12H20O4
Exact Mass 228.136 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP002226
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:40:01.214932
MetadataModified 2025-02-09T12:09:07.594044
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
30073047 eMolecules
16338245 PubChem: Thomson Pharma
SCHEMBL12699010 SureChEMBL
2770979 PubChem
ZINC000000160445 ZINC
J1.642.176F Nikkaji
The data in this table is sourced from UniChem at EBI.