CID 212588

24589-00-2

Structural Information

Molecular Formula
C19H23NO4
SMILES
C1COCCN1CC(COC2=CC=CC=C2OC3=CC=CC=C3)O
InChI
InChI=1S/C19H23NO4/c21-16(14-20-10-12-22-13-11-20)15-23-18-8-4-5-9-19(18)24-17-6-2-1-3-7-17/h1-9,16,21H,10-15H2
InChIKey
QOJXKZSLMXEGJZ-UHFFFAOYSA-N
Compound name
1-morpholin-4-yl-3-(2-phenoxyphenoxy)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.16272 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.169996 177.5
[M+Na]+ 352.151938 179.9
[M-H]- 328.155444 183.5
[M+NH4]+ 347.196543 186.6
[M+K]+ 368.125878 177.7
[M+H-H2O]+ 312.159980 167.0
[M+HCOO]- 374.160921 193.2
[M+CH3COO]- 388.176571 204.4
[M+Na-2H]- 350.137386 180.8
[M]+ 329.16217142 175.9
[M]- 329.16326858 175.9
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.