Dataset

2-(4-NITROBENZYLOXY)TROPONE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010983 contains the MS mass spectrum of 2-(4-NITROBENZYLOXY)TROPONE with the InChIkey YQDITWJHEDBVFV-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H11NO4/c16-13-4-2-1-3-5-14(13)19-10-11-6-8-12(9-7-11)15(17)18/h1-9H,10H2
SMILES [O-1][N+1](=O)c(c1)ccc(COC(=C2)C(=O)C=CC=C2)c1
InChI Key YQDITWJHEDBVFV-UHFFFAOYSA-N
Molecular Formula C14H11NO4
Exact Mass 257.069 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-JP010983
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:54:54.843344
MetadataModified 2024-01-11T15:54:54.996165
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
15790611 PubChem: Thomson Pharma
10753613 PubChem
The data in this table is sourced from UniChem at EBI.