CID 15921596

4-tert-butyl-n-methylcyclohexan-1-amine

Structural Information

Molecular Formula
C11H23N
SMILES
CC(C)(C)C1CCC(CC1)NC
InChI
InChI=1S/C11H23N/c1-11(2,3)9-5-7-10(12-4)8-6-9/h9-10,12H,5-8H2,1-4H3
InChIKey
INGRKTXZUZXXPB-UHFFFAOYSA-N
Compound name
4-tert-butyl-N-methylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

109
Patents

169.18304 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.190316 142.1
[M+Na]+ 192.172258 146.2
[M-H]- 168.175764 144.9
[M+NH4]+ 187.216863 162.6
[M+K]+ 208.146198 144.9
[M+H-H2O]+ 152.180300 136.9
[M+HCOO]- 214.181241 161.1
[M+CH3COO]- 228.196891 184.1
[M+Na-2H]- 190.157706 146.5
[M]+ 169.18249142 137.5
[M]- 169.18358858 137.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe