CID 65912221

Tert-butyl n-[2-amino-1-(4-methylcyclohexyl)ethyl]carbamate

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC1CCC(CC1)C(CN)NC(=O)OC(C)(C)C
InChI
InChI=1S/C14H28N2O2/c1-10-5-7-11(8-6-10)12(9-15)16-13(17)18-14(2,3)4/h10-12H,5-9,15H2,1-4H3,(H,16,17)
InChIKey
WCTFOUSSKZTZAO-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-amino-1-(4-methylcyclohexyl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.2151 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.22238 165.1
[M+Na]+ 279.20432 166.9
[M-H]- 255.20782 166.8
[M+NH4]+ 274.24892 181.2
[M+K]+ 295.17826 166.0
[M+H-H2O]+ 239.21236 158.8
[M+HCOO]- 301.21330 182.2
[M+CH3COO]- 315.22895 201.3
[M+Na-2H]- 277.18977 164.9
[M]+ 256.21455 160.6
[M]- 256.21565 160.6
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

No patent data available for this compound.