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]+ 308.258406 185.3
[M+Na]+ 330.240348 187.5
[M-H]- 306.243854 188.0
[M+NH4]+ 325.284953 205.5
[M+K]+ 346.214288 185.9
[M+H-H2O]+ 290.248390 179.8
[M+HCOO]- 352.249331 202.2
[M+CH3COO]- 366.264981 216.1
[M+Na-2H]- 328.225796 179.2
[M]+ 307.25058142 187.2
[M]- 307.25167858 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.