CID 203178

14028-05-8

Structural Information

Molecular Formula
C19H28N2O5
SMILES
CCCCCOC(=O)C1=C(C=C(C=C1)NC(=O)CCN2CCOCC2)O
InChI
InChI=1S/C19H28N2O5/c1-2-3-4-11-26-19(24)16-6-5-15(14-17(16)22)20-18(23)7-8-21-9-12-25-13-10-21/h5-6,14,22H,2-4,7-13H2,1H3,(H,20,23)
InChIKey
IAYZPWLLCBFJLH-UHFFFAOYSA-N
Compound name
pentyl 2-hydroxy-4-(3-morpholin-4-ylpropanoylamino)benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.19983 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.20711 189.1
[M+Na]+ 387.18905 197.2
[M+NH4]+ 382.23365 193.1
[M+K]+ 403.16299 192.8
[M-H]- 363.19255 191.2
[M+Na-2H]- 385.17450 191.3
[M]+ 364.19928 190.3
[M]- 364.20038 190.3
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.