Dataset

Irgarol-descyclopropyl

This MassBank record with Accession MSBNK-Athens_Univ-AU204604 contains the MS2 mass spectrum of Irgarol-descyclopropyl with the InChIkey MWWBDLRPMWTLRX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C8H15N5S/c1-8(2,3)13-6-10-5(9)11-7(12-6)14-4/h1-4H3,(H3,9,10,11,12,13)
SMILES CC(C)(C)NC1=NC(=NC(=N1)N)SC
InChI Key MWWBDLRPMWTLRX-UHFFFAOYSA-N
Molecular Formula C8H15N5S
Exact Mass 213.105 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-Athens_Univ-AU204604
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:54:04.682874
MetadataModified 2025-02-08T18:58:38.431386
MetadataPublished 2015-12-04
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
No additional information available for this Dataset.