CID 58542

101564-98-1

Structural Information

Molecular Formula
C15H22N2O
SMILES
CC1=CC(=C(C=C1)C(C)C)OCC2=NCCN2C
InChI
InChI=1S/C15H22N2O/c1-11(2)13-6-5-12(3)9-14(13)18-10-15-16-7-8-17(15)4/h5-6,9,11H,7-8,10H2,1-4H3
InChIKey
CFLGKLHGKWWXEY-UHFFFAOYSA-N
Compound name
1-methyl-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4,5-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 159.2
[M+Na]+ 269.16244 166.8
[M-H]- 245.16594 163.3
[M+NH4]+ 264.20704 176.1
[M+K]+ 285.13638 163.8
[M+H-H2O]+ 229.17048 150.9
[M+HCOO]- 291.17142 179.2
[M+CH3COO]- 305.18707 196.9
[M+Na-2H]- 267.14789 159.8
[M]+ 246.17267 161.0
[M]- 246.17377 161.0
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.