Dataset

Neocuproine; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR301475 contains the MS2 mass spectrum of Neocuproine with the InChIkey IYRGXJIJGHOCFS-UHFFFAOYSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C14H12N2/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9/h3-8H,1-2H3
SMILES	CC1=NC2=C(C=C1)C=CC1=C2N=C(C)C=C1
InChI Key	IYRGXJIJGHOCFS-UHFFFAOYSA-N
Molecular Formula	C14H12N2
Exact Mass	208.264 g/mol

Data and Resources

NeocuproineHTML

Go to source

Related Molecule ⌄

2,9-dimethyl-1,10-phenanthroline

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301475
Version
Author
Maintainer
Language
MetadataPublished	2019-03-28
Related Molecule	2,9-dimethyl-1,10-phenanthroline

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.