CID 77603

2-vinyl-1,3-dioxolane

Structural Information

Molecular Formula
C5H8O2
SMILES
C=CC1OCCO1
InChI
InChI=1S/C5H8O2/c1-2-5-6-3-4-7-5/h2,5H,1,3-4H2
InChIKey
KKBHSBATGOQADJ-UHFFFAOYSA-N
Compound name
2-ethenyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1710
Patents

100.05243 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.05971 116.5
[M+Na]+ 123.04165 123.8
[M-H]- 99.045154 121.1
[M+NH4]+ 118.08625 138.7
[M+K]+ 139.01559 125.9
[M+H-H2O]+ 83.049690 112.3
[M+HCOO]- 145.05063 138.9
[M+CH3COO]- 159.06628 163.3
[M+Na-2H]- 121.02710 124.7
[M]+ 100.05188 116.2
[M]- 100.05298 116.2
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