CID 74331

1696-60-2

Structural Information

Molecular Formula
C16H16N2O4
SMILES
COC1=C(C=CC(=C1)C=NN=CC2=CC(=C(C=C2)O)OC)O
InChI
InChI=1S/C16H16N2O4/c1-21-15-7-11(3-5-13(15)19)9-17-18-10-12-4-6-14(20)16(8-12)22-2/h3-10,19-20H,1-2H3
InChIKey
GGQDJSIYHIRXDW-UHFFFAOYSA-N
Compound name
4-[[(4-hydroxy-3-methoxyphenyl)methylidenehydrazinylidene]methyl]-2-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

115
Patents

300.111 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.11828 167.0
[M+Na]+ 323.10022 175.0
[M-H]- 299.10372 174.5
[M+NH4]+ 318.14482 181.9
[M+K]+ 339.07416 172.0
[M+H-H2O]+ 283.10826 158.5
[M+HCOO]- 345.10920 194.0
[M+CH3COO]- 359.12485 208.3
[M+Na-2H]- 321.08567 172.0
[M]+ 300.11045 171.1
[M]- 300.11155 171.1
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