CID 54593541

3-amino-n,n-dimethylcyclohexane-1-carboxamide

Structural Information

Molecular Formula
C9H18N2O
SMILES
CN(C)C(=O)C1CCCC(C1)N
InChI
InChI=1S/C9H18N2O/c1-11(2)9(12)7-4-3-5-8(10)6-7/h7-8H,3-6,10H2,1-2H3
InChIKey
QCXYZVDUCFHTTO-UHFFFAOYSA-N
Compound name
3-amino-N,N-dimethylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

170.1419 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 139.9
[M+Na]+ 193.131118 143.7
[M-H]- 169.134624 143.6
[M+NH4]+ 188.175723 160.0
[M+K]+ 209.105058 143.8
[M+H-H2O]+ 153.139160 133.7
[M+HCOO]- 215.140101 161.4
[M+CH3COO]- 229.155751 187.5
[M+Na-2H]- 191.116566 141.8
[M]+ 170.14135142 134.6
[M]- 170.14244858 134.6
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