CID 139594453

In-kz007

Structural Information

Molecular Formula
C22H18N2O5
SMILES
CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=C(C=C4)O
InChI
InChI=1S/C22H18N2O5/c1-22(20(26)24(21(27)29-22)23-16-5-3-2-4-6-16)15-7-11-18(12-8-15)28-19-13-9-17(25)10-14-19/h2-14,23,25H,1H3
InChIKey
BYIITKZCRPXYMJ-UHFFFAOYSA-N
Compound name
3-anilino-5-[4-(4-hydroxyphenoxy)phenyl]-5-methyl-1,3-oxazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

390.12158 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.12886 190.0
[M+Na]+ 413.11080 197.7
[M-H]- 389.11430 201.7
[M+NH4]+ 408.15540 200.7
[M+K]+ 429.08474 194.1
[M+H-H2O]+ 373.11884 179.9
[M+HCOO]- 435.11978 210.6
[M+CH3COO]- 449.13543 200.4
[M+Na-2H]- 411.09625 192.5
[M]+ 390.12103 191.2
[M]- 390.12213 191.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.