CID 20795021

N-tert-butyl-2-hydroxyacetamide

Structural Information

Molecular Formula
C6H13NO2
SMILES
CC(C)(C)NC(=O)CO
InChI
InChI=1S/C6H13NO2/c1-6(2,3)7-5(9)4-8/h8H,4H2,1-3H3,(H,7,9)
InChIKey
SGWCSGJBNVWDQO-UHFFFAOYSA-N
Compound name
N-tert-butyl-2-hydroxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

131.09464 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 128.7
[M+Na]+ 154.08386 135.3
[M-H]- 130.08736 128.0
[M+NH4]+ 149.12846 150.0
[M+K]+ 170.05780 135.3
[M+H-H2O]+ 114.09190 124.7
[M+HCOO]- 176.09284 150.2
[M+CH3COO]- 190.10849 172.1
[M+Na-2H]- 152.06931 134.9
[M]+ 131.09409 128.1
[M]- 131.09519 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe