CID 6442278

Brn 3055060

Structural Information

Molecular Formula
C17H23NO
SMILES
C/C(=C\C1=CC=CC=C1)/CC(=O)NC2CCCCC2
InChI
InChI=1S/C17H23NO/c1-14(12-15-8-4-2-5-9-15)13-17(19)18-16-10-6-3-7-11-16/h2,4-5,8-9,12,16H,3,6-7,10-11,13H2,1H3,(H,18,19)/b14-12+
InChIKey
FUWUVSZMCJVUAN-WYMLVPIESA-N
Compound name
(E)-N-cyclohexyl-3-methyl-4-phenylbut-3-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.17798 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.185256 163.7
[M+Na]+ 280.167198 165.2
[M-H]- 256.170704 168.5
[M+NH4]+ 275.211803 179.4
[M+K]+ 296.141138 161.4
[M+H-H2O]+ 240.175240 155.7
[M+HCOO]- 302.176181 182.4
[M+CH3COO]- 316.191831 197.7
[M+Na-2H]- 278.152646 165.0
[M]+ 257.17743142 157.4
[M]- 257.17852858 157.4
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.