CID 199206

Sydnone, 4-methyl-3-(p-tolyl)-

Structural Information

Molecular Formula
C10H11N2O2
SMILES
CC1=CC=C(C=C1)[N+]2=C(C(=O)ON2)C
InChI
InChI=1S/C10H10N2O2/c1-7-3-5-9(6-4-7)12-8(2)10(13)14-11-12/h3-6H,1-2H3/p+1
InChIKey
OFEBTTBEFIUFJB-UHFFFAOYSA-O
Compound name
4-methyl-3-(4-methylphenyl)-2H-oxadiazol-3-ium-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.08205 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.08933 137.0
[M+Na]+ 214.07127 153.4
[M+NH4]+ 209.11587 145.6
[M+K]+ 230.04521 150.2
[M-H]- 190.07477 142.1
[M+Na-2H]- 212.05672 145.2
[M]+ 191.08150 141.1
[M]- 191.08260 141.1
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.