CID 198893

Sydnone, 4-methyl-3-(2-(1-pyrrolidinyl)ethyl)-, monohydrochloride

Structural Information

Molecular Formula
C9H16N3O2
SMILES
CC1=[N+](NOC1=O)CCN2CCCC2
InChI
InChI=1S/C9H15N3O2/c1-8-9(13)14-10-12(8)7-6-11-4-2-3-5-11/h2-7H2,1H3/p+1
InChIKey
LGJRPUJPDYYDSP-UHFFFAOYSA-O
Compound name
4-methyl-3-(2-pyrrolidin-1-ylethyl)-2H-oxadiazol-3-ium-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.12425 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.13153 141.3
[M+Na]+ 221.11347 153.4
[M+NH4]+ 216.15807 148.8
[M+K]+ 237.08741 153.3
[M-H]- 197.11697 144.1
[M+Na-2H]- 219.09892 145.9
[M]+ 198.12370 143.8
[M]- 198.12480 143.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.