CID 135705482

2-((hydroxyimino)methyl)-3-methyl-1-((2-methyl-2-propen-1-yloxy)methyl)imidazolium chloride

Structural Information

Molecular Formula
C10H16N3O2
SMILES
CC(=C)COCN1C=C[N+](=C1/C=N/O)C
InChI
InChI=1S/C10H15N3O2/c1-9(2)7-15-8-13-5-4-12(3)10(13)6-11-14/h4-6H,1,7-8H2,2-3H3/p+1
InChIKey
OWYNUISSNVSYSX-UHFFFAOYSA-O
Compound name
(NE)-N-[[1-methyl-3-(2-methylprop-2-enoxymethyl)imidazol-1-ium-2-yl]methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

210.12425 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.13153 147.0
[M+Na]+ 233.11347 155.0
[M-H]- 209.11697 148.5
[M+NH4]+ 228.15807 164.7
[M+K]+ 249.08741 147.7
[M+H-H2O]+ 193.12151 142.3
[M+HCOO]- 255.12245 169.9
[M+CH3COO]- 269.13810 182.2
[M+Na-2H]- 231.09892 152.7
[M]+ 210.12370 148.3
[M]- 210.12480 148.3
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.