CID 50998845

8-(piperazin-1-yl)-1,2,3,4-tetrahydro-1,7-naphthyridine dihydrochloride

Structural Information

Molecular Formula
C12H18N4
SMILES
C1CC2=C(C(=NC=C2)N3CCNCC3)NC1
InChI
InChI=1S/C12H18N4/c1-2-10-3-5-15-12(11(10)14-4-1)16-8-6-13-7-9-16/h3,5,13-14H,1-2,4,6-9H2
InChIKey
OYOCEAGGKZOLOY-UHFFFAOYSA-N
Compound name
8-piperazin-1-yl-1,2,3,4-tetrahydro-1,7-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.15315 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.160426 153.4
[M+Na]+ 241.142368 157.3
[M-H]- 217.145874 150.9
[M+NH4]+ 236.186973 165.0
[M+K]+ 257.116308 151.3
[M+H-H2O]+ 201.150410 142.9
[M+HCOO]- 263.151351 162.4
[M+CH3COO]- 277.167001 161.0
[M+Na-2H]- 239.127816 158.7
[M]+ 218.15260142 142.0
[M]- 218.15369858 142.0
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.