CID 36385

2-(alpha-ethoxybenzyl)-5-methyl-2-imidazoline

Structural Information

Molecular Formula
C13H18N2O
SMILES
CCOC(C1=CC=CC=C1)C2=NCC(N2)C
InChI
InChI=1S/C13H18N2O/c1-3-16-12(11-7-5-4-6-8-11)13-14-9-10(2)15-13/h4-8,10,12H,3,9H2,1-2H3,(H,14,15)
InChIKey
QQBOGZMGQOAYOZ-UHFFFAOYSA-N
Compound name
2-[ethoxy(phenyl)methyl]-5-methyl-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1419 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 151.1
[M+Na]+ 241.13112 157.2
[M-H]- 217.13462 153.4
[M+NH4]+ 236.17572 167.7
[M+K]+ 257.10506 153.8
[M+H-H2O]+ 201.13916 142.8
[M+HCOO]- 263.14010 170.2
[M+CH3COO]- 277.15575 186.0
[M+Na-2H]- 239.11657 153.7
[M]+ 218.14135 149.5
[M]- 218.14245 149.5
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.