CID 10342

2-methyl-1,3-dioxolane

Structural Information

Molecular Formula
C4H8O2
SMILES
CC1OCCO1
InChI
InChI=1S/C4H8O2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3
InChIKey
HTWIZMNMTWYQRN-UHFFFAOYSA-N
Compound name
2-methyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

45
References

8451
Patents

88.05243 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.059706 113.3
[M+Na]+ 111.04165 124.3
[M+NH4]+ 106.08625 122.6
[M+K]+ 127.01559 121.7
[M-H]- 87.045154 117.2
[M+Na-2H]- 109.02710 117.9
[M]+ 88.051881 115.9
[M]- 88.052979 115.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe