Dataset

M-CRESYL METHYL ETHER

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007217 contains the MS mass spectrum of M-CRESYL METHYL ETHER with the InChIkey OSIGJGFTADMDOB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3
SMILES COc(c1)cc(C)cc1
InChI Key OSIGJGFTADMDOB-UHFFFAOYSA-N
Molecular Formula C8H10O
Exact Mass 122.073 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-JP007217
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:57:10.286053
MetadataModified 2024-01-11T15:57:10.483713
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
7530 PubChem
16153791 PubChem: Thomson Pharma
SCHEMBL12353 SureChEMBL
100-84-5 ACToR
J4.985I Nikkaji
10025142 NMRShiftDB
BIMVEB CCDC
50008537 BindingDB
167079 ChEBI
ZINC000001693360 ZINC
MCULE-7649681864 Mcule
DTXSID2051500 EPA CompTox Dashboard
UI9I3Y6WTZ FDA SRS
CB0247362 ChemicalBook
482460 eMolecules
CHEMBL349791 ChEMBL
The data in this table is sourced from UniChem at EBI.