CID 130063643

6-bromo-2,4-dimethyl-1h-indole

Structural Information

Molecular Formula
C10H10BrN
SMILES
CC1=CC(=CC2=C1C=C(N2)C)Br
InChI
InChI=1S/C10H10BrN/c1-6-3-8(11)5-10-9(6)4-7(2)12-10/h3-5,12H,1-2H3
InChIKey
XNEQIDAJFKZBFK-UHFFFAOYSA-N
Compound name
6-bromo-2,4-dimethyl-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.99966 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.00694 142.6
[M+Na]+ 245.98888 147.7
[M+NH4]+ 241.03348 148.5
[M+K]+ 261.96282 147.8
[M-H]- 221.99238 143.5
[M+Na-2H]- 243.97433 146.1
[M]+ 222.99911 142.5
[M]- 223.00021 142.5
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.