CID 780892

2-propenoic acid, 3-[4-[[(4-methoxyphenyl)methylene]amino]phenyl]-, ethyl ester

Structural Information

Molecular Formula
C19H19NO3
SMILES
CCOC(=O)/C=C/C1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC
InChI
InChI=1S/C19H19NO3/c1-3-23-19(21)13-8-15-4-9-17(10-5-15)20-14-16-6-11-18(22-2)12-7-16/h4-14H,3H2,1-2H3/b13-8+,20-14?
InChIKey
FMNNRRPDXZWUAE-KGCZTCBMSA-N
Compound name
ethyl (E)-3-[4-[(4-methoxyphenyl)methylideneamino]phenyl]prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

309.1365 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.14378 173.4
[M+Na]+ 332.12572 179.9
[M-H]- 308.12922 181.2
[M+NH4]+ 327.17032 188.4
[M+K]+ 348.09966 176.1
[M+H-H2O]+ 292.13376 164.5
[M+HCOO]- 354.13470 198.9
[M+CH3COO]- 368.15035 209.3
[M+Na-2H]- 330.11117 177.0
[M]+ 309.13595 177.5
[M]- 309.13705 177.5
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