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]+ 215.11789 145.7
[M+Na]+ 237.09983 155.1
[M-H]- 213.10333 149.8
[M+NH4]+ 232.14443 166.9
[M+K]+ 253.07377 150.9
[M+H-H2O]+ 197.10787 139.1
[M+HCOO]- 259.10881 167.4
[M+CH3COO]- 273.12446 158.9
[M+Na-2H]- 235.08528 151.8
[M]+ 214.11006 145.4
[M]- 214.11116 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.