CID 83898431

(5-bromo-7-methyl-1h-indol-2-yl)methanamine

Structural Information

Molecular Formula
C10H11BrN2
SMILES
CC1=CC(=CC2=C1NC(=C2)CN)Br
InChI
InChI=1S/C10H11BrN2/c1-6-2-8(11)3-7-4-9(5-12)13-10(6)7/h2-4,13H,5,12H2,1H3
InChIKey
DGARGIMGASMFNM-UHFFFAOYSA-N
Compound name
(5-bromo-7-methyl-1H-indol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.01056 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.01784 145.4
[M+Na]+ 260.99978 159.2
[M-H]- 237.00328 150.6
[M+NH4]+ 256.04438 167.8
[M+K]+ 276.97372 146.1
[M+H-H2O]+ 221.00782 145.3
[M+HCOO]- 283.00876 166.8
[M+CH3COO]- 297.02441 160.6
[M+Na-2H]- 258.98523 152.2
[M]+ 238.01001 163.3
[M]- 238.01111 163.3
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.