CID 46895125

(2-iodoethynyl)cyclopropane

Structural Information

Molecular Formula
C5H5I
SMILES
C1CC1C#CI
InChI
InChI=1S/C5H5I/c6-4-3-5-1-2-5/h5H,1-2H2
InChIKey
OSVKYZQZFFKDMI-UHFFFAOYSA-N
Compound name
2-iodoethynylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

191.9436 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.95088 118.2
[M+Na]+ 214.93282 127.5
[M-H]- 190.93632 117.8
[M+NH4]+ 209.97742 132.7
[M+K]+ 230.90676 127.5
[M+H-H2O]+ 174.94086 107.1
[M+HCOO]- 236.94180 134.5
[M+CH3COO]- 250.95745 185.1
[M+Na-2H]- 212.91827 116.7
[M]+ 191.94305 114.4
[M]- 191.94415 114.4
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.