CID 10879760

5-[(z)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol

Structural Information

Molecular Formula
C15H14O4
SMILES
COC1=C(C=C(C=C1)/C=C\C2=CC(=CC(=C2)O)O)O
InChI
InChI=1S/C15H14O4/c1-19-15-5-4-10(8-14(15)18)2-3-11-6-12(16)9-13(17)7-11/h2-9,16-18H,1H3/b3-2-
InChIKey
PHMHDRYYFAYWEG-IHWYPQMZSA-N
Compound name
5-[(Z)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

40
References

412
Patents

258.0892 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.09648 158.2
[M+Na]+ 281.07842 172.0
[M+NH4]+ 276.12302 165.1
[M+K]+ 297.05236 165.7
[M-H]- 257.08192 160.7
[M+Na-2H]- 279.06387 165.0
[M]+ 258.08865 160.8
[M]- 258.08975 160.8
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