Dataset

Benzyl methacrylate

This MassBank record with Accession MSBNK-Athens_Univ-AU505904 contains the MS2 mass spectrum of Benzyl methacrylate with the InChIkey AOJOEFVRHOZDFN-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H12O2/c1-9(2)11(12)13-8-10-6-4-3-5-7-10/h3-7H,1,8H2,2H3
SMILES CC(=C)C(=O)OCC1=CC=CC=C1
InChI Key AOJOEFVRHOZDFN-UHFFFAOYSA-N
Molecular Formula C11H12O2
Exact Mass 176.084 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU505904
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T10:04:29.463110
MetadataModified 2025-02-08T19:06:51.268475
MetadataPublished 2021-04-20
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
Z3248K2SSM FDA SRS
2495-37-6 ACToR
14940829 PubChem: Thomson Pharma
SCHEMBL20996 SureChEMBL
25085-83-0 ACToR
486080 eMolecules
CB7306028 ChemicalBook
CB8698674 ChemicalBook
J60.239F Nikkaji
DTXSID0022193 EPA CompTox Dashboard
CHEMBL3187485 ChEMBL
ZINC000001577283 ZINC
17236 PubChem
20200270 NMRShiftDB
MCULE-7867648503 Mcule
The data in this table is sourced from UniChem at EBI.