CID 145902226

2377035-11-3

Structural Information

Molecular Formula
C9H9BrN2
SMILES
CN1C(=CC2=C1C=C(C=C2)Br)N
InChI
InChI=1S/C9H9BrN2/c1-12-8-5-7(10)3-2-6(8)4-9(12)11/h2-5H,11H2,1H3
InChIKey
JKIJKSBPRRHEHV-UHFFFAOYSA-N
Compound name
6-bromo-1-methylindol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.9949 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.00218 140.0
[M+Na]+ 246.98412 154.6
[M-H]- 222.98762 146.6
[M+NH4]+ 242.02872 163.6
[M+K]+ 262.95806 142.7
[M+H-H2O]+ 206.99216 139.9
[M+HCOO]- 268.99310 163.2
[M+CH3COO]- 283.00875 156.3
[M+Na-2H]- 244.96957 147.8
[M]+ 223.99435 159.4
[M]- 223.99545 159.4
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.