Dataset

Metolachlor-TP SYN547977

This MassBank record with Accession MSBNK-Eawag-EQ01143103 contains the MS2 mass spectrum of Metolachlor-TP SYN547977 with the InChIkey JQPYVRCWJNISTB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H20ClNO3/c1-10-6-5-7-13(12(3)18)15(10)17(14(19)8-16)11(2)9-20-4/h5-7,11H,8-9H2,1-4H3
SMILES ClCC(=O)N(C(C)COC)c1c(C)cccc1C(C)=O
InChI Key JQPYVRCWJNISTB-UHFFFAOYSA-N
Molecular Formula C15H20ClNO3
Exact Mass 297.113 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-Eawag-EQ01143103
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:26:23.828132
MetadataModified 2025-02-09T10:00:54.035854
MetadataPublished 2023-08-10
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
168476556 PubChem
The data in this table is sourced from UniChem at EBI.