CID 3070864

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

Structural Information

Molecular Formula
C12H19N3O
SMILES
CC1CN(C2=C(O1)C=CC=N2)CCN(C)C
InChI
InChI=1S/C12H19N3O/c1-10-9-15(8-7-14(2)3)12-11(16-10)5-4-6-13-12/h4-6,10H,7-9H2,1-3H3
InChIKey
MFSRNUIRTDXABY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(2-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.15282 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.160096 152.3
[M+Na]+ 244.142038 159.1
[M-H]- 220.145544 155.5
[M+NH4]+ 239.186643 168.3
[M+K]+ 260.115978 158.4
[M+H-H2O]+ 204.150080 143.7
[M+HCOO]- 266.151021 171.0
[M+CH3COO]- 280.166671 196.4
[M+Na-2H]- 242.127486 159.0
[M]+ 221.15227142 153.5
[M]- 221.15336858 153.5
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.