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

18
Patents

373.1678 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.175076 192.0
[M+Na]+ 396.157018 196.1
[M-H]- 372.160524 200.8
[M+NH4]+ 391.201623 202.7
[M+K]+ 412.130958 191.2
[M+H-H2O]+ 356.165060 181.5
[M+HCOO]- 418.166001 214.1
[M+CH3COO]- 432.181651 220.0
[M+Na-2H]- 394.142466 193.7
[M]+ 373.16725142 193.1
[M]- 373.16834858 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