CID 3070874

86979-88-6

Structural Information

Molecular Formula
C13H21N3O
SMILES
CCC1CN(C2=C(O1)C=CC=N2)CCN(C)C
InChI
InChI=1S/C13H21N3O/c1-4-11-10-16(9-8-15(2)3)13-12(17-11)6-5-7-14-13/h5-7,11H,4,8-10H2,1-3H3
InChIKey
RPTOXINTWLNCEK-UHFFFAOYSA-N
Compound name
2-(2-ethyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.16846 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.17574 157.0
[M+Na]+ 258.15768 163.3
[M-H]- 234.16118 160.0
[M+NH4]+ 253.20228 172.4
[M+K]+ 274.13162 162.4
[M+H-H2O]+ 218.16572 148.1
[M+HCOO]- 280.16666 175.3
[M+CH3COO]- 294.18231 199.4
[M+Na-2H]- 256.14313 163.1
[M]+ 235.16791 158.5
[M]- 235.16901 158.5
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.