CID 169928

1h-imidazole-1-ethanol, 4,5-dihydro-2-nonyl-

Structural Information

Molecular Formula
C14H28N2O
SMILES
CCCCCCCCCC1=NCCN1CCO
InChI
InChI=1S/C14H28N2O/c1-2-3-4-5-6-7-8-9-14-15-10-11-16(14)12-13-17/h17H,2-13H2,1H3
InChIKey
SCBMJZZCHOUEQV-UHFFFAOYSA-N
Compound name
2-(2-nonyl-4,5-dihydroimidazol-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

146
Patents

240.22017 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.227446 162.7
[M+Na]+ 263.209388 167.3
[M-H]- 239.212894 160.7
[M+NH4]+ 258.253993 178.9
[M+K]+ 279.183328 164.1
[M+H-H2O]+ 223.217430 154.6
[M+HCOO]- 285.218371 180.9
[M+CH3COO]- 299.234021 192.7
[M+Na-2H]- 261.194836 163.5
[M]+ 240.21962142 164.6
[M]- 240.22071858 164.6
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

patents stripe