CID 43400

3-((2-chlorophenyl)methyl)-1-methyl-1h-indole-2-methanamine monohydrochloride

Structural Information

Molecular Formula
C17H17ClN2
SMILES
CN1C2=CC=CC=C2C(=C1CN)CC3=CC=CC=C3Cl
InChI
InChI=1S/C17H17ClN2/c1-20-16-9-5-3-7-13(16)14(17(20)11-19)10-12-6-2-4-8-15(12)18/h2-9H,10-11,19H2,1H3
InChIKey
MOUZVTJRRYFFME-UHFFFAOYSA-N
Compound name
[3-[(2-chlorophenyl)methyl]-1-methylindol-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.10803 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.11531 165.2
[M+Na]+ 307.09725 182.1
[M+NH4]+ 302.14185 175.2
[M+K]+ 323.07119 173.8
[M-H]- 283.10075 171.2
[M+Na-2H]- 305.08270 174.4
[M]+ 284.10748 169.9
[M]- 284.10858 169.9
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.