CID 72765405

1-ethyl-decahydro-1,5-naphthyridine

Structural Information

Molecular Formula
C10H20N2
SMILES
CCN1CCCC2C1CCCN2
InChI
InChI=1S/C10H20N2/c1-2-12-8-4-5-9-10(12)6-3-7-11-9/h9-11H,2-8H2,1H3
InChIKey
VBTYXHPIMMRWPZ-UHFFFAOYSA-N
Compound name
5-ethyl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.16264 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.16992 141.5
[M+Na]+ 191.15186 145.2
[M-H]- 167.15536 140.1
[M+NH4]+ 186.19646 159.3
[M+K]+ 207.12580 142.2
[M+H-H2O]+ 151.15990 134.0
[M+HCOO]- 213.16084 154.1
[M+CH3COO]- 227.17649 177.5
[M+Na-2H]- 189.13731 145.9
[M]+ 168.16209 132.8
[M]- 168.16319 132.8
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.