Dataset

Spirotetramat BYI08330-monohydroxy

This MassBank record with Accession MSBNK-Eawag-EQ01131208 contains the MS2 mass spectrum of Spirotetramat BYI08330-monohydroxy with the InChIkey HPQGJNTUXNUIDL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)
SMILES CC1=CC(=C(C=C1)C)C2C(C3(CCC(CC3)OC)NC2=O)O
InChI Key HPQGJNTUXNUIDL-UHFFFAOYSA-N
Molecular Formula C18H25NO3
Exact Mass 303.183 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-EQ01131208
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:06:53.947435
MetadataModified 2025-02-09T09:53:42.815910
MetadataPublished 2023-04-27
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
9879500 PubChem
14845552 PubChem: Thomson Pharma
DTXSID70432253 EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.