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]+ 344.20088 186.4
[M+Na]+ 366.18282 191.0
[M-H]- 342.18632 192.9
[M+NH4]+ 361.22742 200.0
[M+K]+ 382.15676 184.5
[M+H-H2O]+ 326.19086 177.2
[M+HCOO]- 388.19180 206.6
[M+CH3COO]- 402.20745 217.6
[M+Na-2H]- 364.16827 188.7
[M]+ 343.19305 186.2
[M]- 343.19415 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.