CID 206948

Brn 2855958

Structural Information

Molecular Formula
C17H29NO2
SMILES
CCCN(CC1C(C2CCC1C2)C)C(=O)CCC(=O)C
InChI
InChI=1S/C17H29NO2/c1-4-9-18(17(20)8-5-12(2)19)11-16-13(3)14-6-7-15(16)10-14/h13-16H,4-11H2,1-3H3
InChIKey
CSGXJCKTVAXIES-UHFFFAOYSA-N
Compound name
N-[(3-methyl-2-bicyclo[2.2.1]heptanyl)methyl]-4-oxo-N-propylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.21982 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.22710 171.2
[M+Na]+ 302.20904 176.5
[M+NH4]+ 297.25364 178.3
[M+K]+ 318.18298 174.9
[M-H]- 278.21254 170.7
[M+Na-2H]- 300.19449 169.5
[M]+ 279.21927 171.3
[M]- 279.22037 171.3
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.