CID 146019696

8vfm7jvr1h

Structural Information

Molecular Formula
C22H27NO4
SMILES
CCCN(CC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O)C=O
InChI
InChI=1S/C22H27NO4/c1-2-14-23(17-24)15-19(25)16-27-22-11-7-6-10-20(22)21(26)13-12-18-8-4-3-5-9-18/h3-11,17,19,25H,2,12-16H2,1H3
InChIKey
SKKARMWVNISCQM-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-3-[2-(3-phenylpropanoyl)phenoxy]propyl]-N-propylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.194 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.20128 191.0
[M+Na]+ 392.18322 201.5
[M+NH4]+ 387.22782 196.5
[M+K]+ 408.15716 194.9
[M-H]- 368.18672 194.0
[M+Na-2H]- 390.16867 197.0
[M]+ 369.19345 193.1
[M]- 369.19455 193.1
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.