CID 3079950

Octahydro-3-ethoxy-3-phenylpyrido(2,1-c)(1,4)oxazine hydrochloride

Structural Information

Molecular Formula
C16H23NO2
SMILES
CCOC1(CN2CCCCC2CO1)C3=CC=CC=C3
InChI
InChI=1S/C16H23NO2/c1-2-18-16(14-8-4-3-5-9-14)13-17-11-7-6-10-15(17)12-19-16/h3-5,8-9,15H,2,6-7,10-13H2,1H3
InChIKey
PINOLONZYIASIT-UHFFFAOYSA-N
Compound name
3-ethoxy-3-phenyl-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.17288 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.180156 162.3
[M+Na]+ 284.162098 166.2
[M-H]- 260.165604 167.4
[M+NH4]+ 279.206703 178.5
[M+K]+ 300.136038 164.3
[M+H-H2O]+ 244.170140 153.2
[M+HCOO]- 306.171081 176.7
[M+CH3COO]- 320.186731 172.3
[M+Na-2H]- 282.147546 168.1
[M]+ 261.17233142 158.0
[M]- 261.17342858 158.0
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.