CID 9554030

Brn 1095038

Structural Information

Molecular Formula
C15H21N5O5
SMILES
CC1CN(CCN1CC2CN(C(=O)O2)/N=C/C3=CC=C(O3)[N+](=O)[O-])C
InChI
InChI=1S/C15H21N5O5/c1-11-8-17(2)5-6-18(11)9-13-10-19(15(21)25-13)16-7-12-3-4-14(24-12)20(22)23/h3-4,7,11,13H,5-6,8-10H2,1-2H3/b16-7+
InChIKey
UNPLJKONDXUTJW-FRKPEAEDSA-N
Compound name
5-[(2,4-dimethylpiperazin-1-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

351.15427 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.16155 179.9
[M+Na]+ 374.14349 189.1
[M+NH4]+ 369.18809 184.2
[M+K]+ 390.11743 192.2
[M-H]- 350.14699 185.5
[M+Na-2H]- 372.12894 181.5
[M]+ 351.15372 182.2
[M]- 351.15482 182.2
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.