CID 3079312

Brn 4250867

Structural Information

Molecular Formula
C13H18N2
SMILES
CNC1=C2CCCC2=NC3=C1CCCC3
InChI
InChI=1S/C13H18N2/c1-14-13-9-5-2-3-7-11(9)15-12-8-4-6-10(12)13/h2-8H2,1H3,(H,14,15)
InChIKey
GNRXDYHJVOSOHV-UHFFFAOYSA-N
Compound name
N-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.147 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.154276 144.5
[M+Na]+ 225.136218 150.9
[M-H]- 201.139724 147.8
[M+NH4]+ 220.180823 166.0
[M+K]+ 241.110158 146.9
[M+H-H2O]+ 185.144260 137.5
[M+HCOO]- 247.145201 163.7
[M+CH3COO]- 261.160851 156.5
[M+Na-2H]- 223.121666 150.1
[M]+ 202.14645142 140.4
[M]- 202.14754858 140.4
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.