For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(3E)-3-Hexene-2,5-dione
SpectraBase Compound ID 8Dlw0SE8nnB
InChI InChI=1S/C6H8O2/c1-5(7)3-4-6(2)8/h3-4H,1-2H3/b4-3+
InChIKey OTSKZNVDZOOHRX-ONEGZZNKSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9ImPj5PhFrh
Name (3E)-3-Hexene-2,5-dione
CAS Registry Number 4436-75-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c1-5(7)3-4-6(2)8/h3-4H,1-2H3/b4-3+
InChIKey OTSKZNVDZOOHRX-ONEGZZNKSA-N
Molecular Weight 112.128 g/mol
SMILES C(\C=C\C(C)=O)(C)=O
SPLASH splash10-0007-9100000000-3999cbf577df498922b8
Source of Spectrum K1-2000-2799-11
Synonyms 3-Hexene-2,5-dione (E)-3-hexene-2,5-dione (E)-hex-3-ene-2,5-dione 1,2-Diacetylethylene NSC 11746 NSC 38025
Wiley ID 749987