CID 105432435

7-amino-2,3,4,6-tetrahydro-1h-quinolizin-6-one hydrochloride

Structural Information

Molecular Formula
C9H12N2O
SMILES
C1CCN2C(=CC=C(C2=O)N)C1
InChI
InChI=1S/C9H12N2O/c10-8-5-4-7-3-1-2-6-11(7)9(8)12/h4-5H,1-3,6,10H2
InChIKey
FLNAWLXBSLKTGB-UHFFFAOYSA-N
Compound name
3-amino-6,7,8,9-tetrahydroquinolizin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.09496 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.10224 132.0
[M+Na]+ 187.08418 140.2
[M-H]- 163.08768 134.7
[M+NH4]+ 182.12878 152.1
[M+K]+ 203.05812 137.2
[M+H-H2O]+ 147.09222 125.5
[M+HCOO]- 209.09316 153.1
[M+CH3COO]- 223.10881 179.7
[M+Na-2H]- 185.06963 139.5
[M]+ 164.09441 128.2
[M]- 164.09551 128.2
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.