CID 176472622

1-(2-ethoxyethyl)-2-heptyl-4,5-dihydroimidazole

Structural Information

Molecular Formula
C14H28N2O
SMILES
CCCCCCCC1=NCCN1CCOCC
InChI
InChI=1S/C14H28N2O/c1-3-5-6-7-8-9-14-15-10-11-16(14)12-13-17-4-2/h3-13H2,1-2H3
InChIKey
UDMUOWHJPOVNHW-UHFFFAOYSA-N
Compound name
1-(2-ethoxyethyl)-2-heptyl-4,5-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.22017 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.227446 162.2
[M+Na]+ 263.209388 167.2
[M-H]- 239.212894 161.6
[M+NH4]+ 258.253993 179.1
[M+K]+ 279.183328 164.9
[M+H-H2O]+ 223.217430 153.8
[M+HCOO]- 285.218371 181.9
[M+CH3COO]- 299.234021 195.4
[M+Na-2H]- 261.194836 163.5
[M]+ 240.21962142 166.0
[M]- 240.22071858 166.0
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.