CID 5899084

329779-04-6

Structural Information

Molecular Formula
C24H25NO
SMILES
CC(C)CC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C24H25NO/c1-18(2)16-20-12-10-19(11-13-20)14-15-24(26)25-17-22-8-5-7-21-6-3-4-9-23(21)22/h3-15,18H,16-17H2,1-2H3,(H,25,26)/b15-14+
InChIKey
DPLXRRNPJDDDRV-CCEZHUSRSA-N
Compound name
(E)-3-[4-(2-methylpropyl)phenyl]-N-(naphthalen-1-ylmethyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.1936 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.200876 186.4
[M+Na]+ 366.182818 191.0
[M-H]- 342.186324 192.9
[M+NH4]+ 361.227423 200.0
[M+K]+ 382.156758 184.5
[M+H-H2O]+ 326.190860 177.2
[M+HCOO]- 388.191801 206.6
[M+CH3COO]- 402.207451 217.6
[M+Na-2H]- 364.168266 188.7
[M]+ 343.19305142 186.2
[M]- 343.19414858 186.2
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.