CID 15499631

3-chloro-n-hydroxypropanamide

Structural Information

Molecular Formula
C3H6ClNO2
SMILES
C(CCl)C(=O)NO
InChI
InChI=1S/C3H6ClNO2/c4-2-1-3(6)5-7/h7H,1-2H2,(H,5,6)
InChIKey
TWPQMKAIJRMOGL-UHFFFAOYSA-N
Compound name
3-chloro-N-hydroxypropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

123.008705 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.01598 119.5
[M+Na]+ 145.99792 129.4
[M+NH4]+ 141.04253 127.2
[M+K]+ 161.97186 124.8
[M-H]- 122.00143 118.4
[M+Na-2H]- 143.98337 123.2
[M]+ 123.00816 120.5
[M]- 123.00925 120.5
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