CID 3041352

Brn 0162767

Structural Information

Molecular Formula
C13H14N2O
SMILES
COC1=CC2=C(C=C1)N=C3CCCC3=C2N
InChI
InChI=1S/C13H14N2O/c1-16-8-5-6-12-10(7-8)13(14)9-3-2-4-11(9)15-12/h5-7H,2-4H2,1H3,(H2,14,15)
InChIKey
JBZLIWVDIDZFCY-UHFFFAOYSA-N
Compound name
7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.11061 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.117886 145.7
[M+Na]+ 237.099828 155.1
[M-H]- 213.103334 149.8
[M+NH4]+ 232.144433 166.9
[M+K]+ 253.073768 150.9
[M+H-H2O]+ 197.107870 139.1
[M+HCOO]- 259.108811 167.4
[M+CH3COO]- 273.124461 158.9
[M+Na-2H]- 235.085276 151.8
[M]+ 214.11006142 145.4
[M]- 214.11115858 145.4
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.