CID 65335825

1360899-75-7

Structural Information

Molecular Formula
C10H11ClN2
SMILES
CC1=C(C2=C(N1)C(=CC=C2)Cl)CN
InChI
InChI=1S/C10H11ClN2/c1-6-8(5-12)7-3-2-4-9(11)10(7)13-6/h2-4,13H,5,12H2,1H3
InChIKey
ZHPCECGZSYALTN-UHFFFAOYSA-N
Compound name
(7-chloro-2-methyl-1H-indol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.06108 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.06836 139.9
[M+Na]+ 217.05030 151.7
[M-H]- 193.05380 142.2
[M+NH4]+ 212.09490 161.5
[M+K]+ 233.02424 145.3
[M+H-H2O]+ 177.05834 134.9
[M+HCOO]- 239.05928 159.2
[M+CH3COO]- 253.07493 153.7
[M+Na-2H]- 215.03575 145.4
[M]+ 194.06053 141.2
[M]- 194.06163 141.2
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.