CID 610875

Benzene, 1-methoxy-3-[(1e)-2-phenylethenyl]-

Structural Information

Molecular Formula
C15H14O
SMILES
COC1=CC=CC(=C1)C=CC2=CC=CC=C2
InChI
InChI=1S/C15H14O/c1-16-15-9-5-8-14(12-15)11-10-13-6-3-2-4-7-13/h2-12H,1H3
InChIKey
LZINUFCUTQOYOO-UHFFFAOYSA-N
Compound name
1-methoxy-3-(2-phenylethenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

210.10446 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.111736 146.3
[M+Na]+ 233.093678 153.9
[M-H]- 209.097184 153.0
[M+NH4]+ 228.138283 165.1
[M+K]+ 249.067618 149.7
[M+H-H2O]+ 193.101720 139.2
[M+HCOO]- 255.102661 170.9
[M+CH3COO]- 269.118311 186.8
[M+Na-2H]- 231.079126 153.3
[M]+ 210.10391142 146.8
[M]- 210.10500858 146.8
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