CID 199816

8-bromo-2-methyl-2,3,4,5-tetrahydro-1h-pyrido[4,3-b]indole

Structural Information

Molecular Formula
C12H13BrN2
SMILES
CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)Br
InChI
InChI=1S/C12H13BrN2/c1-15-5-4-12-10(7-15)9-6-8(13)2-3-11(9)14-12/h2-3,6,14H,4-5,7H2,1H3
InChIKey
HFILMDDJKHXWEL-UHFFFAOYSA-N
Compound name
8-bromo-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

264.0262 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.03348 154.6
[M+Na]+ 287.01542 159.1
[M+NH4]+ 282.06002 160.4
[M+K]+ 302.98936 158.9
[M-H]- 263.01892 155.3
[M+Na-2H]- 285.00087 156.7
[M]+ 264.02565 154.3
[M]- 264.02675 154.3
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

patents stripe