CID 10176881

Schembl2318218

Structural Information

Molecular Formula
C14H25NO
SMILES
CC1CCC(C(C1)C(=O)NC2CC2)C(C)C
InChI
InChI=1S/C14H25NO/c1-9(2)12-7-4-10(3)8-13(12)14(16)15-11-5-6-11/h9-13H,4-8H2,1-3H3,(H,15,16)
InChIKey
TYANUEJCOOHPGR-UHFFFAOYSA-N
Compound name
N-cyclopropyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

270
Patents

223.19362 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.200896 151.6
[M+Na]+ 246.182838 156.7
[M-H]- 222.186344 158.2
[M+NH4]+ 241.227443 165.0
[M+K]+ 262.156778 154.0
[M+H-H2O]+ 206.190880 145.0
[M+HCOO]- 268.191821 170.2
[M+CH3COO]- 282.207471 198.1
[M+Na-2H]- 244.168286 151.7
[M]+ 223.19307142 149.9
[M]- 223.19416858 149.9
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.