CID 3079159

2-butoxy-4-methyl-2-phenylmorpholine hydrochloride

Structural Information

Molecular Formula
C15H23NO2
SMILES
CCCCOC1(CN(CCO1)C)C2=CC=CC=C2
InChI
InChI=1S/C15H23NO2/c1-3-4-11-17-15(13-16(2)10-12-18-15)14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3
InChIKey
UBAYXKKBPFGCLS-UHFFFAOYSA-N
Compound name
2-butoxy-4-methyl-2-phenylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.17288 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.18016 159.6
[M+Na]+ 272.16210 164.6
[M-H]- 248.16560 164.6
[M+NH4]+ 267.20670 175.8
[M+K]+ 288.13604 163.4
[M+H-H2O]+ 232.17014 151.4
[M+HCOO]- 294.17108 177.6
[M+CH3COO]- 308.18673 193.3
[M+Na-2H]- 270.14755 165.3
[M]+ 249.17233 159.4
[M]- 249.17343 159.4
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.