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]+ 169.169916 141.5
[M+Na]+ 191.151858 145.2
[M-H]- 167.155364 140.1
[M+NH4]+ 186.196463 159.3
[M+K]+ 207.125798 142.2
[M+H-H2O]+ 151.159900 134.0
[M+HCOO]- 213.160841 154.1
[M+CH3COO]- 227.176491 177.5
[M+Na-2H]- 189.137306 145.9
[M]+ 168.16209142 132.8
[M]- 168.16318858 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.