Dataset

3-METHYL-2,5-PIPERAZINEDIONE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007617 contains the MS mass spectrum of 3-METHYL-2,5-PIPERAZINEDIONE with the InChIkey ICCHEGCKVBMSTF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C5H8N2O2/c1-3-5(9)6-2-4(8)7-3/h3H,2H2,1H3,(H,6,9)(H,7,8)
SMILES CC(N1)C(=O)NCC(=O)1
InChI Key ICCHEGCKVBMSTF-UHFFFAOYSA-N
Molecular Formula C5H8N2O2
Exact Mass 128.059 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-JP007617
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:54:56.834590
MetadataModified 2024-01-11T15:54:56.998853
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
107297 PubChem
DLALGL CCDC
HMDB0031547 Human Metabolome Database
DTXSID90875603 EPA CompTox Dashboard
MTBLC144050 Metabolights
144050 ChEBI
J47.184D Nikkaji
PD157966 ProbesDrugs
SCHEMBL1828632 SureChEMBL
4526-77-6 ACToR
96027822 PubChem: Thomson Pharma
The data in this table is sourced from UniChem at EBI.