CID 3079311

125080-90-2

Structural Information

Molecular Formula
C13H18N2
SMILES
CN1C2=C(CCCC2)C(=N)C3=C1CCC3
InChI
InChI=1S/C13H18N2/c1-15-11-7-3-2-5-9(11)13(14)10-6-4-8-12(10)15/h14H,2-8H2,1H3
InChIKey
JWWCAPXXVIYGGO-UHFFFAOYSA-N
Compound name
4-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

202.147 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.154276 144.3
[M+Na]+ 225.136218 152.0
[M-H]- 201.139724 148.1
[M+NH4]+ 220.180823 166.1
[M+K]+ 241.110158 147.3
[M+H-H2O]+ 185.144260 137.7
[M+HCOO]- 247.145201 163.6
[M+CH3COO]- 261.160851 156.7
[M+Na-2H]- 223.121666 149.2
[M]+ 202.14645142 139.9
[M]- 202.14754858 139.9
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.