CID 52891

74038-82-7

Structural Information

Molecular Formula
C18H36N2O
SMILES
CCCCCCCCCC1=NC(CN1C(C)(C)CO)(C)C
InChI
InChI=1S/C18H36N2O/c1-6-7-8-9-10-11-12-13-16-19-17(2,3)14-20(16)18(4,5)15-21/h21H,6-15H2,1-5H3
InChIKey
MZURFONFBGGQPQ-UHFFFAOYSA-N
Compound name
2-(5,5-dimethyl-2-nonyl-4H-imidazol-3-yl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.28278 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.29006 178.4
[M+Na]+ 319.27200 183.5
[M-H]- 295.27550 176.9
[M+NH4]+ 314.31660 194.9
[M+K]+ 335.24594 180.1
[M+H-H2O]+ 279.28004 171.9
[M+HCOO]- 341.28098 193.8
[M+CH3COO]- 355.29663 205.7
[M+Na-2H]- 317.25745 178.8
[M]+ 296.28223 182.0
[M]- 296.28333 182.0
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.