CID 40594

5,5-dimethyl-2-(alpha-ethoxybenzyl)-2-imidazoline

Structural Information

Molecular Formula
C14H20N2O
SMILES
CCOC(C1=CC=CC=C1)C2=NCC(N2)(C)C
InChI
InChI=1S/C14H20N2O/c1-4-17-12(11-8-6-5-7-9-11)13-15-10-14(2,3)16-13/h5-9,12H,4,10H2,1-3H3,(H,15,16)
InChIKey
MPVRMDGCKMOVFI-UHFFFAOYSA-N
Compound name
2-[ethoxy(phenyl)methyl]-5,5-dimethyl-1,4-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.15756 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16484 154.9
[M+Na]+ 255.14678 161.6
[M-H]- 231.15028 157.4
[M+NH4]+ 250.19138 173.1
[M+K]+ 271.12072 158.2
[M+H-H2O]+ 215.15482 147.1
[M+HCOO]- 277.15576 173.8
[M+CH3COO]- 291.17141 188.5
[M+Na-2H]- 253.13223 158.1
[M]+ 232.15701 154.0
[M]- 232.15811 154.0
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.