CID 10868113

178982-67-7

Structural Information

Molecular Formula
C14H18N2O
SMILES
CC(C)C1=CN=C(N1)COCC2=CC=CC=C2
InChI
InChI=1S/C14H18N2O/c1-11(2)13-8-15-14(16-13)10-17-9-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,15,16)
InChIKey
MLXAYWQAGBEISD-UHFFFAOYSA-N
Compound name
2-(phenylmethoxymethyl)-5-propan-2-yl-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

230.1419 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.149176 154.0
[M+Na]+ 253.131118 160.7
[M-H]- 229.134624 156.5
[M+NH4]+ 248.175723 170.2
[M+K]+ 269.105058 156.8
[M+H-H2O]+ 213.139160 145.5
[M+HCOO]- 275.140101 174.2
[M+CH3COO]- 289.155751 188.7
[M+Na-2H]- 251.116566 157.1
[M]+ 230.14135142 154.2
[M]- 230.14244858 154.2
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

patents stripe