CID 6030176

N-(4-fluorobenzyl)-3-(4-methoxy-1-naphthyl)acrylamide

Structural Information

Molecular Formula
C21H18FNO2
SMILES
COC1=CC=C(C2=CC=CC=C21)/C=C/C(=O)NCC3=CC=C(C=C3)F
InChI
InChI=1S/C21H18FNO2/c1-25-20-12-8-16(18-4-2-3-5-19(18)20)9-13-21(24)23-14-15-6-10-17(22)11-7-15/h2-13H,14H2,1H3,(H,23,24)/b13-9+
InChIKey
MZBSGXKLWQUYMR-UKTHLTGXSA-N
Compound name
(E)-N-[(4-fluorophenyl)methyl]-3-(4-methoxynaphthalen-1-yl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.13217 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.13945 180.5
[M+Na]+ 358.12139 194.6
[M+NH4]+ 353.16599 188.1
[M+K]+ 374.09533 185.2
[M-H]- 334.12489 184.7
[M+Na-2H]- 356.10684 188.4
[M]+ 335.13162 183.7
[M]- 335.13272 183.7
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

No patent data available for this compound.