CID 3084908

50261-59-1

Structural Information

Molecular Formula
C24H29NO5
SMILES
CCCCCOC(=O)OC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC(=O)CCCC
InChI
InChI=1S/C24H29NO5/c1-3-5-7-17-28-24(27)30-22-15-11-20(12-16-22)25-18-19-9-13-21(14-10-19)29-23(26)8-6-4-2/h9-16,18H,3-8,17H2,1-2H3
InChIKey
AMHOXZKEIVGXFJ-UHFFFAOYSA-N
Compound name
[4-[(4-pentoxycarbonyloxyphenyl)iminomethyl]phenyl] pentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

411.20456 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 412.21184 201.9
[M+Na]+ 434.19378 212.8
[M+NH4]+ 429.23838 206.7
[M+K]+ 450.16772 205.2
[M-H]- 410.19728 204.7
[M+Na-2H]- 432.17923 207.5
[M]+ 411.20401 204.0
[M]- 411.20511 204.0
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

patents stripe