CID 129929332

2172023-19-5

Structural Information

Molecular Formula
C10H15N3
SMILES
C1CC2C(CCC3=C2N=CN3)NC1
InChI
InChI=1S/C10H15N3/c1-2-7-8(11-5-1)3-4-9-10(7)13-6-12-9/h6-8,11H,1-5H2,(H,12,13)
InChIKey
WRVHORQXXLTWRI-UHFFFAOYSA-N
Compound name
4,5,5a,6,7,8,9,9a-octahydro-3H-imidazo[4,5-f]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.1266 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.13388 140.1
[M+Na]+ 200.11582 145.9
[M-H]- 176.11932 137.5
[M+NH4]+ 195.16042 158.3
[M+K]+ 216.08976 141.0
[M+H-H2O]+ 160.12386 132.1
[M+HCOO]- 222.12480 152.0
[M+CH3COO]- 236.14045 150.0
[M+Na-2H]- 198.10127 145.1
[M]+ 177.12605 131.2
[M]- 177.12715 131.2
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.