CID 3079954

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

Structural Information

Molecular Formula
C18H27NO2
SMILES
CCCCOC1(CN2CCCCC2CO1)C3=CC=CC=C3
InChI
InChI=1S/C18H27NO2/c1-2-3-13-20-18(16-9-5-4-6-10-16)15-19-12-8-7-11-17(19)14-21-18/h4-6,9-10,17H,2-3,7-8,11-15H2,1H3
InChIKey
NSOKLCINHACAOH-UHFFFAOYSA-N
Compound name
3-butoxy-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

289.2042 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.21148 172.7
[M+Na]+ 312.19342 185.0
[M+NH4]+ 307.23802 183.1
[M+K]+ 328.16736 174.7
[M-H]- 288.19692 178.5
[M+Na-2H]- 310.17887 179.6
[M]+ 289.20365 176.3
[M]- 289.20475 176.3
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.