CID 3084907

50261-16-0

Structural Information

Molecular Formula
C20H23NO4
SMILES
CCCCCOC(=O)OC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC
InChI
InChI=1S/C20H23NO4/c1-3-4-5-14-24-20(22)25-19-10-6-16(7-11-19)15-21-17-8-12-18(23-2)13-9-17/h6-13,15H,3-5,14H2,1-2H3
InChIKey
BDWQITLMXFJLGJ-UHFFFAOYSA-N
Compound name
[4-[(4-methoxyphenyl)iminomethyl]phenyl] pentyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

341.16272 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.17000 182.7
[M+Na]+ 364.15194 195.3
[M+NH4]+ 359.19654 189.2
[M+K]+ 380.12588 187.3
[M-H]- 340.15544 186.7
[M+Na-2H]- 362.13739 190.3
[M]+ 341.16217 185.5
[M]- 341.16327 185.5
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