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]+ 305.22238 176.1
[M+Na]+ 327.20432 183.0
[M-H]- 303.20782 183.4
[M+NH4]+ 322.24892 198.2
[M+K]+ 343.17826 182.0
[M+H-H2O]+ 287.21236 171.6
[M+HCOO]- 349.21330 195.5
[M+CH3COO]- 363.22895 212.7
[M+Na-2H]- 325.18977 173.5
[M]+ 304.21455 180.4
[M]- 304.21565 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.