Dataset

BENZYL METHYL ETHER

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP000204 contains the MS mass spectrum of BENZYL METHYL ETHER with the InChIkey GQKZBCPTCWJTAS-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C8H10O/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
SMILES COCc(c1)cccc1
InChI Key GQKZBCPTCWJTAS-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-JP000204
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:54.298266
MetadataModified 2024-01-11T15:55:54.454225
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-4554043273 Mcule
10016685 NMRShiftDB
10869 PubChem
62256 Brenda
CB5184400 ChemicalBook
J45.676D Nikkaji
ZINC000001586379 ZINC
HMDB0303847 Human Metabolome Database
DTXSID5060227 EPA CompTox Dashboard
GUNNUY CCDC
16153792 PubChem: Thomson Pharma
513129 eMolecules
538-86-3 ACToR
SCHEMBL794 SureChEMBL
F22RLS78BD FDA SRS
The data in this table is sourced from UniChem at EBI.