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]+ 256.190716 161.6
[M+Na]+ 278.172658 164.2
[M-H]- 254.176164 163.8
[M+NH4]+ 273.217263 178.1
[M+K]+ 294.146598 163.5
[M+H-H2O]+ 238.180700 156.0
[M+HCOO]- 300.181641 178.1
[M+CH3COO]- 314.197291 196.4
[M+Na-2H]- 276.158106 165.3
[M]+ 255.18289142 159.4
[M]- 255.18398858 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.