CID 204978

17159-27-2

Structural Information

Molecular Formula
C14H16N2O4
SMILES
COC1=CC=C(C=C1)C2C(=O)N=C(O2)N3CCOCC3
InChI
InChI=1S/C14H16N2O4/c1-18-11-4-2-10(3-5-11)12-13(17)15-14(20-12)16-6-8-19-9-7-16/h2-5,12H,6-9H2,1H3
InChIKey
ITUYCBPIJYEGIR-UHFFFAOYSA-N
Compound name
5-(4-methoxyphenyl)-2-morpholin-4-yl-1,3-oxazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.111 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.11828 161.6
[M+Na]+ 299.10022 168.4
[M-H]- 275.10372 169.7
[M+NH4]+ 294.14482 173.6
[M+K]+ 315.07416 168.0
[M+H-H2O]+ 259.10826 152.6
[M+HCOO]- 321.10920 178.8
[M+CH3COO]- 335.12485 173.1
[M+Na-2H]- 297.08567 164.3
[M]+ 276.11045 161.4
[M]- 276.11155 161.4
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.