CID 6673

Dicyclopentadiene diepoxide

Structural Information

Molecular Formula
C10H12O2
SMILES
C1C2C3CC4C(C3C1C5C2O5)O4
InChI
InChI=1S/C10H12O2/c1-4-3-2-6-10(11-6)7(3)5(1)9-8(4)12-9/h3-10H,1-2H2
InChIKey
BQQUFAMSJAKLNB-UHFFFAOYSA-N
Compound name
4,10-dioxapentacyclo[6.3.1.02,7.03,5.09,11]dodecane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

9868
Patents

164.08372 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.09100 140.0
[M+Na]+ 187.07294 150.7
[M-H]- 163.07644 146.9
[M+NH4]+ 182.11754 155.1
[M+K]+ 203.04688 148.0
[M+H-H2O]+ 147.08098 137.7
[M+HCOO]- 209.08192 152.2
[M+CH3COO]- 223.09757 151.6
[M+Na-2H]- 185.05839 143.2
[M]+ 164.08317 146.6
[M]- 164.08427 146.6
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

No patent data available for this compound.