CID 3079946

4-butyl-2-phenyl-2-propoxymorpholine hydrochloride

Structural Information

Molecular Formula
C17H27NO2
SMILES
CCCCN1CCOC(C1)(C2=CC=CC=C2)OCCC
InChI
InChI=1S/C17H27NO2/c1-3-5-11-18-12-14-20-17(15-18,19-13-4-2)16-9-7-6-8-10-16/h6-10H,3-5,11-15H2,1-2H3
InChIKey
AGUIDNMKLLUEAO-UHFFFAOYSA-N
Compound name
4-butyl-2-phenyl-2-propoxymorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.2042 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.21148 169.2
[M+Na]+ 300.19342 181.6
[M+NH4]+ 295.23802 178.6
[M+K]+ 316.16736 171.7
[M-H]- 276.19692 174.2
[M+Na-2H]- 298.17887 176.9
[M]+ 277.20365 172.6
[M]- 277.20475 172.6
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.