CID 50398

Brn 3241441

Structural Information

Molecular Formula
C10H17NO
SMILES
CC1(CC2CCC1CC2)C(=O)N
InChI
InChI=1S/C10H17NO/c1-10(9(11)12)6-7-2-4-8(10)5-3-7/h7-8H,2-6H2,1H3,(H2,11,12)
InChIKey
RMXNMWHEZQBBGA-UHFFFAOYSA-N
Compound name
2-methylbicyclo[2.2.2]octane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 135.3
[M+Na]+ 190.12023 143.8
[M+NH4]+ 185.16483 147.5
[M+K]+ 206.09417 135.7
[M-H]- 166.12373 133.9
[M+Na-2H]- 188.10568 134.5
[M]+ 167.13046 136.0
[M]- 167.13156 136.0
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.