CID 14195430

N-ethyl-3-hydroxybutanamide

Structural Information

Molecular Formula
C6H13NO2
SMILES
CCNC(=O)CC(C)O
InChI
InChI=1S/C6H13NO2/c1-3-7-6(9)4-5(2)8/h5,8H,3-4H2,1-2H3,(H,7,9)
InChIKey
GSIPBDZNJDVUEQ-UHFFFAOYSA-N
Compound name
N-ethyl-3-hydroxybutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

131.09464 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 128.8
[M+Na]+ 154.08386 136.9
[M+NH4]+ 149.12846 135.6
[M+K]+ 170.05780 133.2
[M-H]- 130.08736 127.4
[M+Na-2H]- 152.06931 131.1
[M]+ 131.09409 129.1
[M]- 131.09519 129.1
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

patents stripe