CID 9926715

6-chloro-2,3,4,9-tetrahydro-1h-carbazol-3-amine

Structural Information

Molecular Formula
C12H13ClN2
SMILES
C1CC2=C(CC1N)C3=C(N2)C=CC(=C3)Cl
InChI
InChI=1S/C12H13ClN2/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1,3,5,8,15H,2,4,6,14H2
InChIKey
BODQGEOXSNZRGK-UHFFFAOYSA-N
Compound name
6-chloro-2,3,4,9-tetrahydro-1H-carbazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

220.07672 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.083996 146.4
[M+Na]+ 243.065938 156.7
[M-H]- 219.069444 148.9
[M+NH4]+ 238.110543 167.6
[M+K]+ 259.039878 149.6
[M+H-H2O]+ 203.073980 140.9
[M+HCOO]- 265.074921 162.0
[M+CH3COO]- 279.090571 158.9
[M+Na-2H]- 241.051386 151.8
[M]+ 220.07617142 144.6
[M]- 220.07726858 144.6
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