Dataset

META-METHYLPHENETOLE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004024 contains the MS mass spectrum of META-METHYLPHENETOLE with the InChIkey UALKQROXOHJHFG-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H12O/c1-3-10-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3
SMILES CCOc(c1)cc(C)cc1
InChI Key UALKQROXOHJHFG-UHFFFAOYSA-N
Molecular Formula C9H12O
Exact Mass 136.089 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-JP004024
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:56:29.260374
MetadataModified 2024-01-11T15:56:29.448536
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
16250637 PubChem: Thomson Pharma
SCHEMBL129831 SureChEMBL
31656911 eMolecules
621-32-9 ACToR
ZINC000001693362 ZINC
DTXSID4060733 EPA CompTox Dashboard
MCULE-3762844024 Mcule
JZ7GFC4MN9 FDA SRS
J30.192B Nikkaji
69305 PubChem
The data in this table is sourced from UniChem at EBI.