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]+ 233.164836 154.9
[M+Na]+ 255.146778 161.6
[M-H]- 231.150284 157.4
[M+NH4]+ 250.191383 173.1
[M+K]+ 271.120718 158.2
[M+H-H2O]+ 215.154820 147.1
[M+HCOO]- 277.155761 173.8
[M+CH3COO]- 291.171411 188.5
[M+Na-2H]- 253.132226 158.1
[M]+ 232.15701142 154.0
[M]- 232.15810858 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.