CID 9589199

3-((1-methylpyrrol-2-ylmethylene)amino)-2-oxazolidone

Structural Information

Molecular Formula
C9H11N3O2
SMILES
CN1C=CC=C1/C=N/N2CCOC2=O
InChI
InChI=1S/C9H11N3O2/c1-11-4-2-3-8(11)7-10-12-5-6-14-9(12)13/h2-4,7H,5-6H2,1H3/b10-7+
InChIKey
MYWOKQJVYIXCCC-JXMROGBWSA-N
Compound name
3-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 139.8
[M+Na]+ 216.07435 148.2
[M-H]- 192.07785 146.2
[M+NH4]+ 211.11895 159.2
[M+K]+ 232.04829 148.0
[M+H-H2O]+ 176.08239 132.2
[M+HCOO]- 238.08333 164.3
[M+CH3COO]- 252.09898 184.7
[M+Na-2H]- 214.05980 143.6
[M]+ 193.08458 140.7
[M]- 193.08568 140.7
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.