CID 117237

2,5-furandione, 3-(decenyl)dihydro-

Structural Information

Molecular Formula
C14H22O3
SMILES
C=CCCCCCCCCC1CC(=O)OC1=O
InChI
InChI=1S/C14H22O3/c1-2-3-4-5-6-7-8-9-10-12-11-13(15)17-14(12)16/h2,12H,1,3-11H2
InChIKey
JVKGGERSFUBGEE-UHFFFAOYSA-N
Compound name
3-dec-9-enyloxolane-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

238.15689 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.164166 157.3
[M+Na]+ 261.146108 163.1
[M-H]- 237.149614 160.4
[M+NH4]+ 256.190713 175.6
[M+K]+ 277.120048 161.1
[M+H-H2O]+ 221.154150 151.7
[M+HCOO]- 283.155091 178.3
[M+CH3COO]- 297.170741 193.0
[M+Na-2H]- 259.131556 158.4
[M]+ 238.15634142 160.5
[M]- 238.15743858 160.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe