Dataset

2-ISOBUTYL-4,5-DIMETHYLTHIAZOLE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007801 contains the MS mass spectrum of 2-ISOBUTYL-4,5-DIMETHYLTHIAZOLE with the InChIkey NSVPHVLZAKJSGV-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H15NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6H,5H2,1-4H3
SMILES CC(C)Cc(n1)sc(C)c(C)1
InChI Key NSVPHVLZAKJSGV-UHFFFAOYSA-N
Molecular Formula C9H15NS
Exact Mass 169.093 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-JP007801
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:53.220532
MetadataModified 2024-01-11T15:55:53.383396
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
713920 eMolecules
104513 PubChem
53498-32-1 ACToR
5P82VD25ZI FDA SRS
SCHEMBL3505082 SureChEMBL
J47.703F Nikkaji
CB0243278 ChemicalBook
ZINC000002510294 ZINC
DTXSID6068858 EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.