CID 43814

Domiodol

Structural Information

Molecular Formula
C5H9IO3
SMILES
C1C(OC(O1)CI)CO
InChI
InChI=1S/C5H9IO3/c6-1-5-8-3-4(2-7)9-5/h4-5,7H,1-3H2
InChIKey
NEIPZWZQHXCYDV-UHFFFAOYSA-N
Compound name
[2-(iodomethyl)-1,3-dioxolan-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

11
References

2265
Patents

243.95964 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.96692 135.2
[M+Na]+ 266.94886 137.5
[M+NH4]+ 261.99346 138.7
[M+K]+ 282.92280 138.5
[M-H]- 242.95236 131.5
[M+Na-2H]- 264.93431 125.3
[M]+ 243.95909 133.2
[M]- 243.96019 133.2
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