CID 334086

2-bromo-n-methylaniline

Structural Information

Molecular Formula
C7H8BrN
SMILES
CNC1=CC=CC=C1Br
InChI
InChI=1S/C7H8BrN/c1-9-7-5-3-2-4-6(7)8/h2-5,9H,1H3
InChIKey
SMVIAQFTVWDWDS-UHFFFAOYSA-N
Compound name
2-bromo-N-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

250
Patents

184.98401 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.99129 130.0
[M+Na]+ 207.97323 133.9
[M+NH4]+ 203.01783 136.0
[M+K]+ 223.94717 133.1
[M-H]- 183.97673 132.0
[M+Na-2H]- 205.95868 135.2
[M]+ 184.98346 129.9
[M]- 184.98456 129.9
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