CID 9554022

Pm 338

Structural Information

Molecular Formula
C14H18N4O6
SMILES
CC1CN(CCO1)CC2CN(C(=O)O2)/N=C/C3=CC=C(O3)[N+](=O)[O-]
InChI
InChI=1S/C14H18N4O6/c1-10-7-16(4-5-22-10)8-12-9-17(14(19)24-12)15-6-11-2-3-13(23-11)18(20)21/h2-3,6,10,12H,4-5,7-9H2,1H3/b15-6+
InChIKey
ATOUVPVDDJWSLJ-GIDUJCDVSA-N
Compound name
5-[(2-methylmorpholin-4-yl)methyl]-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.12262 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.12990 178.5
[M+Na]+ 361.11184 182.2
[M-H]- 337.11534 188.4
[M+NH4]+ 356.15644 187.5
[M+K]+ 377.08578 179.3
[M+H-H2O]+ 321.11988 174.7
[M+HCOO]- 383.12082 197.3
[M+CH3COO]- 397.13647 206.1
[M+Na-2H]- 359.09729 181.5
[M]+ 338.12207 177.3
[M]- 338.12317 177.3
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.