CID 135705424

1-((cyclooctyloxy)methyl)-2-((hydroxyimino)methyl)-3-methylimidazolium chloride

Structural Information

Molecular Formula
C14H24N3O2
SMILES
C[N+]1=C(N(C=C1)COC2CCCCCCC2)/C=N/O
InChI
InChI=1S/C14H23N3O2/c1-16-9-10-17(14(16)11-15-18)12-19-13-7-5-3-2-4-6-8-13/h9-11,13H,2-8,12H2,1H3/p+1
InChIKey
FJDJQICUQCGQJW-UHFFFAOYSA-O
Compound name
(NE)-N-[[1-(cyclooctyloxymethyl)-3-methylimidazol-3-ium-2-yl]methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

266.18686 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.19414 153.4
[M+Na]+ 289.17608 156.9
[M+NH4]+ 284.22068 155.9
[M+K]+ 305.15002 156.9
[M-H]- 265.17958 154.6
[M+Na-2H]- 287.16153 156.3
[M]+ 266.18631 154.1
[M]- 266.18741 154.1
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.