MCM (v3.3.1)
Home
Browse
Export
About
AtChemOnline Tutorial
Construction Method
Useful links
Cite
Contributors
Funding
Previous versions
Select Mechanism (MCM, CRI)
MCM (v3.3.1)
CRI (v2.2)
Advanced Search
C826O
Add to marklist
Species information
Smiles: O=CCC(CC=O)C(C)([O])CO
InChI: InChI=1S/C8H13O4/c1-8(12,6-11)7(2-4-9)3-5-10/h4-5,7,11H,2-3,6H2,1H3
Mass: 173.1864
Synonyms:
External links:
Google
,
ChemSpider
,
PubChem
,
NIST WebBook
,
IUPAC
,
ChEBI
Reactions
C826O
→
KDEC
C626CHO
+
HCHO
+
HO2
Doc
Precursors
Show precursor reactions
C826O2
+
NO
→
KRO2NO
⋅
0.931
C826O
+
NO2
Doc
C826O2
+
NO3
→
KRO2NO3
C826O
+
NO2
Doc
C826O2
→
9.20
×
10
A
−
14
⋅
RO2
⋅
0.7
C826O
Doc
C826OOH
→
J
<
41
>
C826O
+
OH
Doc
C826OOH
→
J
<
15
>
⋅
2
C826O
+
OH
Doc
C826OH
+
OH
→
5.70
×
10
A
−
11
C826O
Doc
C826OH
→
J
<
15
>
⋅
2
C826O
+
HO2
Doc
1
2
Marklist
Clear
Export