Dataset

ETHYL PHENYLACETATE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009599 contains the MS mass spectrum of ETHYL PHENYLACETATE with the InChIkey DULCUDSUACXJJC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H12O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
SMILES CCOC(=O)Cc(c1)cccc1
InChI Key DULCUDSUACXJJC-UHFFFAOYSA-N
Molecular Formula C10H12O2
Exact Mass 164.084 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-JP009599
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:54:50.682346
MetadataModified 2024-01-11T15:54:50.856895
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
478220 eMolecules
PD158318 ProbesDrugs
SCHEMBL112999 SureChEMBL
15237826 PubChem: Thomson Pharma
101-97-3 ACToR
180411 ChEBI
V6CNZ04D8O FDA SRS
CB6701512 ChemicalBook
HMDB0032618 Human Metabolome Database
ZINC000000388060 ZINC
DTXSID6044353 EPA CompTox Dashboard
MCULE-6999453149 Mcule
CHEMBL3183476 ChEMBL
J2.846K Nikkaji
7590 PubChem
10008700 NMRShiftDB
The data in this table is sourced from UniChem at EBI.