CID 3071825

Dihydro-5-(4-chlorophenyl)-3-((2-hydroxyethyl)amino)-2(3h)-furanone hydrochloride

Structural Information

Molecular Formula
C12H14ClNO3
SMILES
C1C(C(=O)OC1C2=CC=C(C=C2)Cl)NCCO
InChI
InChI=1S/C12H14ClNO3/c13-9-3-1-8(2-4-9)11-7-10(12(16)17-11)14-5-6-15/h1-4,10-11,14-15H,5-7H2
InChIKey
FUPYLLGNKCHOON-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-3-(2-hydroxyethylamino)oxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.06622 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.07350 154.7
[M+Na]+ 278.05544 166.3
[M+NH4]+ 273.10004 162.5
[M+K]+ 294.02938 161.9
[M-H]- 254.05894 158.9
[M+Na-2H]- 276.04089 159.7
[M]+ 255.06567 157.6
[M]- 255.06677 157.6
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.