CID 17381

2-ethyl-1,3-dioxolane

Structural Information

Molecular Formula
C5H10O2
SMILES
CCC1OCCO1
InChI
InChI=1S/C5H10O2/c1-2-5-6-3-4-7-5/h5H,2-4H2,1H3
InChIKey
WEBRDDDJKLAXTO-UHFFFAOYSA-N
Compound name
2-ethyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1468
Patents

102.06808 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.075356 117.8
[M+Na]+ 125.057298 124.8
[M-H]- 101.060804 122.3
[M+NH4]+ 120.101903 140.0
[M+K]+ 141.031238 127.4
[M+H-H2O]+ 85.065340 113.5
[M+HCOO]- 147.066281 140.0
[M+CH3COO]- 161.081931 164.2
[M+Na-2H]- 123.042746 125.9
[M]+ 102.06753142 118.1
[M]- 102.06862858 118.1
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