Dataset

2-ALLYL-2-METHYLCYCLOHEXANONE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP002319 contains the MS mass spectrum of 2-ALLYL-2-METHYLCYCLOHEXANONE with the InChIkey FGDGJMZVLROUMG-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H16O/c1-3-7-10(2)8-5-4-6-9(10)11/h3H,1,4-8H2,2H3
SMILES C=CCC(C)(C1)C(=O)CCC1
InChI Key FGDGJMZVLROUMG-UHFFFAOYSA-N
Molecular Formula C10H16O
Exact Mass 152.120 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-JP002319
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:12:15.654812
MetadataModified 2025-02-09T12:41:54.030460
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J47.883K Nikkaji
11062571 PubChem
16129926 PubChem: Thomson Pharma
SCHEMBL1137957 SureChEMBL
The data in this table is sourced from UniChem at EBI.