CID 114080

63716-34-7

Structural Information

Molecular Formula
C12H16N2
SMILES
C1CCC2C(C1)C3=C(N2)C=CC(=C3)N
InChI
InChI=1S/C12H16N2/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h5-7,9,11,14H,1-4,13H2
InChIKey
KJPSTPLYLNVOAA-UHFFFAOYSA-N
Compound name
5,6,7,8,8a,9-hexahydro-4bH-carbazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.13135 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.13863 140.5
[M+Na]+ 211.12057 147.0
[M-H]- 187.12407 142.2
[M+NH4]+ 206.16517 161.6
[M+K]+ 227.09451 142.0
[M+H-H2O]+ 171.12861 134.2
[M+HCOO]- 233.12955 157.9
[M+CH3COO]- 247.14520 152.1
[M+Na-2H]- 209.10602 145.3
[M]+ 188.13080 133.3
[M]- 188.13190 133.3
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

No patent data available for this compound.