CID 84729310

Tert-butyl n-(2-cyclohexyl-1-oxopropan-2-yl)carbamate

Structural Information

Molecular Formula
C14H25NO3
SMILES
CC(C)(C)OC(=O)NC(C)(C=O)C1CCCCC1
InChI
InChI=1S/C14H25NO3/c1-13(2,3)18-12(17)15-14(4,10-16)11-8-6-5-7-9-11/h10-11H,5-9H2,1-4H3,(H,15,17)
InChIKey
HTVNTKWHFSWMGZ-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-cyclohexyl-1-oxopropan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.18344 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.19072 161.6
[M+Na]+ 278.17266 164.2
[M-H]- 254.17616 163.8
[M+NH4]+ 273.21726 178.1
[M+K]+ 294.14660 163.5
[M+H-H2O]+ 238.18070 156.0
[M+HCOO]- 300.18164 178.1
[M+CH3COO]- 314.19729 196.4
[M+Na-2H]- 276.15811 165.3
[M]+ 255.18289 159.4
[M]- 255.18399 159.4
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.