CID 3070862

2h-pyrido(3,2-b)-1,4-oxazine, 3,4-dihydro-4-(2-(1-piperidinyl)ethyl)-, trihydrochloride

Structural Information

Molecular Formula
C14H21N3O
SMILES
C1CCN(CC1)CCN2CCOC3=C2N=CC=C3
InChI
InChI=1S/C14H21N3O/c1-2-7-16(8-3-1)9-10-17-11-12-18-13-5-4-6-15-14(13)17/h4-6H,1-3,7-12H2
InChIKey
XVPXWVYWAWEGLQ-UHFFFAOYSA-N
Compound name
4-(2-piperidin-1-ylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.16846 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.17574 159.4
[M+Na]+ 270.15768 163.2
[M-H]- 246.16118 161.3
[M+NH4]+ 265.20228 171.3
[M+K]+ 286.13162 160.4
[M+H-H2O]+ 230.16572 148.5
[M+HCOO]- 292.16666 171.5
[M+CH3COO]- 306.18231 168.3
[M+Na-2H]- 268.14313 165.0
[M]+ 247.16791 153.7
[M]- 247.16901 153.7
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.