CID 11031766

2-iodo-n-methylaniline hydrochloride

Structural Information

Molecular Formula
C7H8IN
SMILES
CNC1=CC=CC=C1I
InChI
InChI=1S/C7H8IN/c1-9-7-5-3-2-4-6(7)8/h2-5,9H,1H3
InChIKey
WSLMOORTNOTZCO-UHFFFAOYSA-N
Compound name
2-iodo-N-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

232.97015 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.97743 133.1
[M+Na]+ 255.95937 138.5
[M+NH4]+ 251.00397 138.4
[M+K]+ 271.93331 134.8
[M-H]- 231.96287 130.3
[M+Na-2H]- 253.94482 128.7
[M]+ 232.96960 132.0
[M]- 232.97070 132.0
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