CID 11008290

3-chloro-1h-indol-7-amine

Structural Information

Molecular Formula
C8H7ClN2
SMILES
C1=CC2=C(C(=C1)N)NC=C2Cl
InChI
InChI=1S/C8H7ClN2/c9-6-4-11-8-5(6)2-1-3-7(8)10/h1-4,11H,10H2
InChIKey
SLBNABPPSZSXHN-UHFFFAOYSA-N
Compound name
3-chloro-1H-indol-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

166.02977 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.03705 130.2
[M+Na]+ 189.01899 142.0
[M-H]- 165.02249 132.5
[M+NH4]+ 184.06359 152.6
[M+K]+ 204.99293 136.1
[M+H-H2O]+ 149.02703 125.3
[M+HCOO]- 211.02797 150.2
[M+CH3COO]- 225.04362 144.6
[M+Na-2H]- 187.00444 137.6
[M]+ 166.02922 130.5
[M]- 166.03032 130.5
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

patents stripe