CID 3087666

N-benzyl-3,3-bis(4-methoxyphenyl)acrylamide

Structural Information

Molecular Formula
C24H23NO3
SMILES
COC1=CC=C(C=C1)C(=CC(=O)NCC2=CC=CC=C2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C24H23NO3/c1-27-21-12-8-19(9-13-21)23(20-10-14-22(28-2)15-11-20)16-24(26)25-17-18-6-4-3-5-7-18/h3-16H,17H2,1-2H3,(H,25,26)
InChIKey
HKKQHKSIIQXQBK-UHFFFAOYSA-N
Compound name
N-benzyl-3,3-bis(4-methoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

373.1678 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.17508 192.0
[M+Na]+ 396.15702 196.1
[M-H]- 372.16052 200.8
[M+NH4]+ 391.20162 202.7
[M+K]+ 412.13096 191.2
[M+H-H2O]+ 356.16506 181.5
[M+HCOO]- 418.16600 214.1
[M+CH3COO]- 432.18165 220.0
[M+Na-2H]- 394.14247 193.7
[M]+ 373.16725 193.1
[M]- 373.16835 193.1
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