CID 11971172

2-(dimethylheptyl)-4,5-dihydro-1h-imidazole-1-ethanol

Structural Information

Molecular Formula
C14H28N2O
SMILES
CCCCCCC(C)(C)C1=NCCN1CCO
InChI
InChI=1S/C14H28N2O/c1-4-5-6-7-8-14(2,3)13-15-9-10-16(13)11-12-17/h17H,4-12H2,1-3H3
InChIKey
RGSKVIGUZKNKTI-UHFFFAOYSA-N
Compound name
2-[2-(2-methyloctan-2-yl)-4,5-dihydroimidazol-1-yl]ethanol
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 163.7
[M+Na]+ 263.209388 168.7
[M-H]- 239.212894 162.2
[M+NH4]+ 258.253993 180.1
[M+K]+ 279.183328 165.9
[M+H-H2O]+ 223.217430 156.4
[M+HCOO]- 285.218371 180.3
[M+CH3COO]- 299.234021 193.1
[M+Na-2H]- 261.194836 165.3
[M]+ 240.21962142 165.1
[M]- 240.22071858 165.1
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.