CID 14511499

145842-51-9

Structural Information

Molecular Formula
C5H11NO2
SMILES
C[C@H](CO)NC(=O)C
InChI
InChI=1S/C5H11NO2/c1-4(3-7)6-5(2)8/h4,7H,3H2,1-2H3,(H,6,8)/t4-/m1/s1
InChIKey
LFVBTAFBWUVUHV-SCSAIBSYSA-N
Compound name
N-[(2R)-1-hydroxypropan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

117.07898 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.086256 124.8
[M+Na]+ 140.068198 131.0
[M-H]- 116.071704 124.0
[M+NH4]+ 135.112803 146.4
[M+K]+ 156.042138 131.3
[M+H-H2O]+ 100.076240 120.3
[M+HCOO]- 162.077181 147.1
[M+CH3COO]- 176.092831 170.3
[M+Na-2H]- 138.053646 129.5
[M]+ 117.07843142 123.7
[M]- 117.07952858 123.7
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