CID 91259

Methyl p-(n,n-diphenylamino)cinnamate

Structural Information

Molecular Formula
C22H19NO2
SMILES
COC(=O)C=CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C22H19NO2/c1-25-22(24)17-14-18-12-15-21(16-13-18)23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-17H,1H3
InChIKey
BXVLFTQOFFZWCZ-UHFFFAOYSA-N
Compound name
methyl 3-[4-(N-phenylanilino)phenyl]prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

329.14157 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.14885 179.9
[M+Na]+ 352.13079 184.7
[M-H]- 328.13429 190.2
[M+NH4]+ 347.17539 193.0
[M+K]+ 368.10473 180.1
[M+H-H2O]+ 312.13883 169.7
[M+HCOO]- 374.13977 204.0
[M+CH3COO]- 388.15542 213.3
[M+Na-2H]- 350.11624 183.7
[M]+ 329.14102 180.4
[M]- 329.14212 180.4
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