CID 93591

N,n-diethyl-2-isopropyl-5-methylcyclohexanecarboxamide

Structural Information

Molecular Formula
C15H29NO
SMILES
CCN(CC)C(=O)C1CC(CCC1C(C)C)C
InChI
InChI=1S/C15H29NO/c1-6-16(7-2)15(17)14-10-12(5)8-9-13(14)11(3)4/h11-14H,6-10H2,1-5H3
InChIKey
BSGVGVMGCACGDE-UHFFFAOYSA-N
Compound name
N,N-diethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

239.22491 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.232186 161.8
[M+Na]+ 262.214128 164.7
[M-H]- 238.217634 165.5
[M+NH4]+ 257.258733 180.1
[M+K]+ 278.188068 164.2
[M+H-H2O]+ 222.222170 155.4
[M+HCOO]- 284.223111 179.9
[M+CH3COO]- 298.238761 203.5
[M+Na-2H]- 260.199576 159.5
[M]+ 239.22436142 160.3
[M]- 239.22545858 160.3
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

patents stripe