CID 32557

(+-)-endo-n-2-bornyl-3,5-dimethyl-4-isoxazolepropionamide

Structural Information

Molecular Formula
C18H28N2O2
SMILES
CC1=C(C(=NO1)C)CCC(=O)N(C)C2CC3CCC2C3(C)C
InChI
InChI=1S/C18H28N2O2/c1-11-14(12(2)22-19-11)7-9-17(21)20(5)16-10-13-6-8-15(16)18(13,3)4/h13,15-16H,6-10H2,1-5H3
InChIKey
XQYFKKHCXDSXGF-UHFFFAOYSA-N
Compound name
N-(7,7-dimethyl-2-bicyclo[2.2.1]heptanyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.2151 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.222376 176.1
[M+Na]+ 327.204318 183.0
[M-H]- 303.207824 183.4
[M+NH4]+ 322.248923 198.2
[M+K]+ 343.178258 182.0
[M+H-H2O]+ 287.212360 171.6
[M+HCOO]- 349.213301 195.5
[M+CH3COO]- 363.228951 212.7
[M+Na-2H]- 325.189766 173.5
[M]+ 304.21455142 180.4
[M]- 304.21564858 180.4
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.