CID 18071390

4-amino-n-methylcyclohexane-1-carboxamide hydrochloride

Structural Information

Molecular Formula
C8H16N2O
SMILES
CNC(=O)C1CCC(CC1)N
InChI
InChI=1S/C8H16N2O/c1-10-8(11)6-2-4-7(9)5-3-6/h6-7H,2-5,9H2,1H3,(H,10,11)
InChIKey
BAAXLXOXUTWMSB-UHFFFAOYSA-N
Compound name
4-amino-N-methylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

156.12627 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 135.3
[M+Na]+ 179.11549 139.4
[M-H]- 155.11899 137.8
[M+NH4]+ 174.16009 155.3
[M+K]+ 195.08943 138.3
[M+H-H2O]+ 139.12353 129.4
[M+HCOO]- 201.12447 156.6
[M+CH3COO]- 215.14012 181.0
[M+Na-2H]- 177.10094 138.6
[M]+ 156.12572 128.4
[M]- 156.12682 128.4
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