Dataset

DEP_150.1278_9.6

This MassBank record with Accession MSBNK-Eawag_Additional_Specs-ET050201 contains the MS2 mass spectrum of DEP_150.1278_9.6 with the InChIkey MYWUZJCMWCOHBA-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
SMILES CNC(C)CC1=CC=CC=C1
InChI Key MYWUZJCMWCOHBA-UHFFFAOYSA-N
Molecular Formula C10H15N
Exact Mass 149.120 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-Eawag_Additional_Specs-ET050201
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:49:40.774098
MetadataModified 2025-02-09T11:07:17.412383
MetadataPublished 2016-03-17
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL508 ChEMBL
13ZT6YG5SD FDA SRS
DTXSID3043861 EPA CompTox Dashboard
4803 Guide to Pharmacology
50009057 BindingDB
HMDB0251523 Human Metabolome Database
J8.954K Nikkaji
30639-16-8 ACToR
7632-10-2 ACToR
PD051719 ProbesDrugs
1206 PubChem
SCHEMBL42178 SureChEMBL
15194698 PubChem: Thomson Pharma
15843 Brenda
The data in this table is sourced from UniChem at EBI.