CID 23444208

38698-16-7

Structural Information

Molecular Formula
C12H23NO2
SMILES
CC(C)(C)OC(=O)C1CCC(CC1)CN
InChI
InChI=1S/C12H23NO2/c1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10/h9-10H,4-8,13H2,1-3H3
InChIKey
IVWIMGAJPJCWHY-UHFFFAOYSA-N
Compound name
tert-butyl 4-(aminomethyl)cyclohexane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

213.17288 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.18016 151.6
[M+Na]+ 236.16210 159.5
[M+NH4]+ 231.20670 158.8
[M+K]+ 252.13604 155.1
[M-H]- 212.16560 152.3
[M+Na-2H]- 234.14755 154.4
[M]+ 213.17233 152.6
[M]- 213.17343 152.6
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