Dataset

MENTHYL SALICYLATE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008994 contains the MS mass spectrum of MENTHYL SALICYLATE with the InChIkey SJOXEWUZWQYCGL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H24O3/c1-11(2)13-9-8-12(3)10-16(13)20-17(19)14-6-4-5-7-15(14)18/h4-7,11-13,16,18H,8-10H2,1-3H3
SMILES CC(C1)CC(OC(=O)c(c2)c(O)ccc2)C(C1)C(C)C
InChI Key SJOXEWUZWQYCGL-UHFFFAOYSA-N
Molecular Formula C17H24O3
Exact Mass 276.173 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-JP008994
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:25:48.554746
MetadataModified 2025-02-09T12:56:59.457986
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CB4412889 ChemicalBook
DTXSID70858853 EPA CompTox Dashboard
J4.303F Nikkaji
CHEMBL1905909 ChEMBL
SCHEMBL17780 SureChEMBL
6970 PubChem
PD014337 ProbesDrugs
95032-40-9 ACToR
89-46-3 ACToR
25466-32-4 ACToR
14848590 PubChem: Thomson Pharma
531395 eMolecules
The data in this table is sourced from UniChem at EBI.