CID 3079948

2-butoxy-4-butyl-2-phenylmorpholine hydrochloride

Structural Information

Molecular Formula
C18H29NO2
SMILES
CCCCN1CCOC(C1)(C2=CC=CC=C2)OCCCC
InChI
InChI=1S/C18H29NO2/c1-3-5-12-19-13-15-21-18(16-19,20-14-6-4-2)17-10-8-7-9-11-17/h7-11H,3-6,12-16H2,1-2H3
InChIKey
YSTZHJFFZPJXHH-UHFFFAOYSA-N
Compound name
2-butoxy-4-butyl-2-phenylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.21982 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.22710 173.7
[M+Na]+ 314.20904 185.8
[M+NH4]+ 309.25364 182.9
[M+K]+ 330.18298 175.8
[M-H]- 290.21254 178.6
[M+Na-2H]- 312.19449 181.1
[M]+ 291.21927 177.0
[M]- 291.22037 177.0
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.