CID 154577364

1998236-29-5

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC1(CCC(CC1)(CN)NC(=O)OC(C)(C)C)C
InChI
InChI=1S/C14H28N2O2/c1-12(2,3)18-11(17)16-14(10-15)8-6-13(4,5)7-9-14/h6-10,15H2,1-5H3,(H,16,17)
InChIKey
QTKVXSGSCFWWHO-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(aminomethyl)-4,4-dimethylcyclohexyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.2151 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.22238 161.7
[M+Na]+ 279.20432 168.1
[M+NH4]+ 274.24892 170.8
[M+K]+ 295.17826 160.6
[M-H]- 255.20782 162.5
[M+Na-2H]- 277.18977 167.2
[M]+ 256.21455 162.8
[M]- 256.21565 162.8
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

No patent data available for this compound.