CID 475891

1-benzyloxymethyl-5-(3,5-dimethyl-benzyl)-4-isopropyl-2-methyl-1h-imidazole

Structural Information

Molecular Formula
C24H30N2O
SMILES
CC1=CC(=CC(=C1)CC2=C(N=C(N2COCC3=CC=CC=C3)C)C(C)C)C
InChI
InChI=1S/C24H30N2O/c1-17(2)24-23(14-22-12-18(3)11-19(4)13-22)26(20(5)25-24)16-27-15-21-9-7-6-8-10-21/h6-13,17H,14-16H2,1-5H3
InChIKey
PQBIECWHWNZUHZ-UHFFFAOYSA-N
Compound name
5-[(3,5-dimethylphenyl)methyl]-2-methyl-1-(phenylmethoxymethyl)-4-propan-2-ylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.2358 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.243076 192.5
[M+Na]+ 385.225018 200.1
[M-H]- 361.228524 199.9
[M+NH4]+ 380.269623 204.6
[M+K]+ 401.198958 194.1
[M+H-H2O]+ 345.233060 182.2
[M+HCOO]- 407.234001 212.1
[M+CH3COO]- 421.249651 221.3
[M+Na-2H]- 383.210466 190.0
[M]+ 362.23525142 196.9
[M]- 362.23634858 196.9
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.