CID 5744387

1,8-naphthyridine, 1,2,3,4-tetrahydro-5-(2-(dimethylamino)ethoxy)-1-methyl-

Structural Information

Molecular Formula
C13H21N3O
SMILES
CN1CCCC2=C(C=CN=C21)OCCN(C)C
InChI
InChI=1S/C13H21N3O/c1-15(2)9-10-17-12-6-7-14-13-11(12)5-4-8-16(13)3/h6-7H,4-5,8-10H2,1-3H3
InChIKey
WHOOAEMKBXDYLQ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[(8-methyl-6,7-dihydro-5H-1,8-naphthyridin-4-yl)oxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.16846 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.17574 155.7
[M+Na]+ 258.15768 161.8
[M-H]- 234.16118 158.1
[M+NH4]+ 253.20228 172.4
[M+K]+ 274.13162 160.1
[M+H-H2O]+ 218.16572 146.9
[M+HCOO]- 280.16666 175.0
[M+CH3COO]- 294.18231 199.4
[M+Na-2H]- 256.14313 161.3
[M]+ 235.16791 156.6
[M]- 235.16901 156.6
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.