CID 135705424

1h-imidazolium, 1-((cyclooctyloxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, 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]+ 267.194136 160.5
[M+Na]+ 289.176078 164.2
[M-H]- 265.179584 162.3
[M+NH4]+ 284.220683 167.3
[M+K]+ 305.150018 161.7
[M+H-H2O]+ 249.184120 156.6
[M+HCOO]- 311.185061 169.0
[M+CH3COO]- 325.200711 225.5
[M+Na-2H]- 287.161526 160.3
[M]+ 266.18631142 158.7
[M]- 266.18740858 158.7
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.