CID 3079163

4-methyl-2-(octyloxy)-2-phenylmorpholine hydrochloride

Structural Information

Molecular Formula
C19H31NO2
SMILES
CCCCCCCCOC1(CN(CCO1)C)C2=CC=CC=C2
InChI
InChI=1S/C19H31NO2/c1-3-4-5-6-7-11-15-21-19(17-20(2)14-16-22-19)18-12-9-8-10-13-18/h8-10,12-13H,3-7,11,14-17H2,1-2H3
InChIKey
VJRLMIXNWWBXJG-UHFFFAOYSA-N
Compound name
4-methyl-2-octoxy-2-phenylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.23547 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.24275 178.2
[M+Na]+ 328.22469 190.1
[M+NH4]+ 323.26929 187.2
[M+K]+ 344.19863 179.8
[M-H]- 304.22819 183.0
[M+Na-2H]- 326.21014 185.3
[M]+ 305.23492 181.4
[M]- 305.23602 181.4
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.