CID 13212025

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

Structural Information

Molecular Formula
C17H20N2O
SMILES
CCC1CN(C2=C(O1)C=CC=N2)C(C)C3=CC=CC=C3
InChI
InChI=1S/C17H20N2O/c1-3-15-12-19(13(2)14-8-5-4-6-9-14)17-16(20-15)10-7-11-18-17/h4-11,13,15H,3,12H2,1-2H3
InChIKey
MJCJITLAZSKAPA-UHFFFAOYSA-N
Compound name
2-ethyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.15756 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.16484 164.6
[M+Na]+ 291.14678 171.0
[M-H]- 267.15028 169.3
[M+NH4]+ 286.19138 177.7
[M+K]+ 307.12072 167.5
[M+H-H2O]+ 251.15482 154.7
[M+HCOO]- 313.15576 180.4
[M+CH3COO]- 327.17141 175.1
[M+Na-2H]- 289.13223 170.0
[M]+ 268.15701 163.6
[M]- 268.15811 163.6
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.