CID 24690155

1-amino-n-butylcyclohexane-1-carboxamide

Structural Information

Molecular Formula
C11H22N2O
SMILES
CCCCNC(=O)C1(CCCCC1)N
InChI
InChI=1S/C11H22N2O/c1-2-3-9-13-10(14)11(12)7-5-4-6-8-11/h2-9,12H2,1H3,(H,13,14)
InChIKey
ZPPXVPIDPWAJOG-UHFFFAOYSA-N
Compound name
1-amino-N-butylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

198.17322 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.180496 148.4
[M+Na]+ 221.162438 151.1
[M-H]- 197.165944 150.2
[M+NH4]+ 216.207043 168.4
[M+K]+ 237.136378 149.6
[M+H-H2O]+ 181.170480 142.6
[M+HCOO]- 243.171421 168.7
[M+CH3COO]- 257.187071 188.5
[M+Na-2H]- 219.147886 151.9
[M]+ 198.17267142 142.5
[M]- 198.17376858 142.5
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