CID 99704

50765-91-8

Structural Information

Molecular Formula
C24H32N2O
SMILES
CC(=CCC(CCN1CCCCC1)(C2=CC=CC3=CC=CC=C32)C(=O)N)C
InChI
InChI=1S/C24H32N2O/c1-19(2)13-14-24(23(25)27,15-18-26-16-6-3-7-17-26)22-12-8-10-20-9-4-5-11-21(20)22/h4-5,8-13H,3,6-7,14-18H2,1-2H3,(H2,25,27)
InChIKey
DRQHMYYWGQFHOV-UHFFFAOYSA-N
Compound name
5-methyl-2-naphthalen-1-yl-2-(2-piperidin-1-ylethyl)hex-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.25146 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.25874 193.2
[M+Na]+ 387.24068 203.3
[M+NH4]+ 382.28528 200.2
[M+K]+ 403.21462 195.7
[M-H]- 363.24418 196.8
[M+Na-2H]- 385.22613 198.3
[M]+ 364.25091 195.5
[M]- 364.25201 195.5
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.