Dataset

(1S,9S)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80065 contains the MS mass spectrum of (1S,9S)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.0]trideca-2,4-dien-6-one with the InChIkey ZVTFRRVBMAUIQW-UEWDXFNNSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H20N2O/c1-2-3-7-16-9-12-8-13(11-16)14-5-4-6-15(18)17(14)10-12/h2,4-6,12-13H,1,3,7-11H2/t12-,13?/m0/s1
SMILES C=CCCN1C[C@@H]2CC(C1)C3=CC=CC(=O)N3C2
InChI Key ZVTFRRVBMAUIQW-UEWDXFNNSA-N
Molecular Formula C15H20N2O
Exact Mass 244.158 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80065
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:26:12.642007
MetadataModified 2024-01-11T22:26:12.804781
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
6732846 PubChem
The data in this table is sourced from UniChem at EBI.