CID 10703476

3-[2-(4-aminophenyl)ethyl]-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C11H14N2O2
SMILES
C1COC(=O)N1CCC2=CC=C(C=C2)N
InChI
InChI=1S/C11H14N2O2/c12-10-3-1-9(2-4-10)5-6-13-7-8-15-11(13)14/h1-4H,5-8,12H2
InChIKey
UFZDPIAAXRLUNR-UHFFFAOYSA-N
Compound name
3-[2-(4-aminophenyl)ethyl]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

206.10553 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.112806 144.8
[M+Na]+ 229.094748 151.9
[M-H]- 205.098254 150.3
[M+NH4]+ 224.139353 162.3
[M+K]+ 245.068688 150.1
[M+H-H2O]+ 189.102790 137.5
[M+HCOO]- 251.103731 166.9
[M+CH3COO]- 265.119381 185.9
[M+Na-2H]- 227.080196 148.8
[M]+ 206.10498142 143.1
[M]- 206.10607858 143.1
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