CID 205909

18966-39-7

Structural Information

Molecular Formula
C19H33NO2
SMILES
CC1C2CCC(C2)C1CN(CCC(C)C)C(=O)CCC(=O)C
InChI
InChI=1S/C19H33NO2/c1-13(2)9-10-20(19(22)8-5-14(3)21)12-18-15(4)16-6-7-17(18)11-16/h13,15-18H,5-12H2,1-4H3
InChIKey
XNZOFGWRDCPRSP-UHFFFAOYSA-N
Compound name
N-[(3-methyl-2-bicyclo[2.2.1]heptanyl)methyl]-N-(3-methylbutyl)-4-oxopentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.25113 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.25841 185.3
[M+Na]+ 330.24035 187.5
[M-H]- 306.24385 188.0
[M+NH4]+ 325.28495 205.5
[M+K]+ 346.21429 185.9
[M+H-H2O]+ 290.24839 179.8
[M+HCOO]- 352.24933 202.2
[M+CH3COO]- 366.26498 216.1
[M+Na-2H]- 328.22580 179.2
[M]+ 307.25058 187.2
[M]- 307.25168 187.2
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.