CID 141479

1-iodo-2-methylbutane

Structural Information

Molecular Formula
C5H11I
SMILES
CCC(C)CI
InChI
InChI=1S/C5H11I/c1-3-5(2)4-6/h5H,3-4H2,1-2H3
InChIKey
RHBHXHXNWHTGSO-UHFFFAOYSA-N
Compound name
1-iodo-2-methylbutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

342
Patents

197.99055 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.99783 124.3
[M+Na]+ 220.97977 128.0
[M+NH4]+ 216.02437 129.1
[M+K]+ 236.95371 125.5
[M-H]- 196.98327 118.6
[M+Na-2H]- 218.96522 116.8
[M]+ 197.99000 122.1
[M]- 197.99110 122.1
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