CID 218246

Verbindungen 320 [german]

Structural Information

Molecular Formula
C11H12N2O
SMILES
CN1C=C(N=C1)C2=CC=C(C=C2)OC
InChI
InChI=1S/C11H12N2O/c1-13-7-11(12-8-13)9-3-5-10(14-2)6-4-9/h3-8H,1-2H3
InChIKey
IWUMIMWFLSUQER-UHFFFAOYSA-N
Compound name
4-(4-methoxyphenyl)-1-methylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

188.09496 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10224 139.1
[M+Na]+ 211.08418 148.9
[M-H]- 187.08768 143.8
[M+NH4]+ 206.12878 158.2
[M+K]+ 227.05812 146.2
[M+H-H2O]+ 171.09222 131.2
[M+HCOO]- 233.09316 163.0
[M+CH3COO]- 247.10881 182.6
[M+Na-2H]- 209.06963 144.8
[M]+ 188.09441 141.2
[M]- 188.09551 141.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe