CID 482310

Rd-3-0193

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC1=CC(=C(C(=C1)C=NCCN=CC2=CC(=CC(=C2O)C)C)O)C
InChI
InChI=1S/C20H24N2O2/c1-13-7-15(3)19(23)17(9-13)11-21-5-6-22-12-18-10-14(2)8-16(4)20(18)24/h7-12,23-24H,5-6H2,1-4H3
InChIKey
VAQYUCBDVXOKLM-UHFFFAOYSA-N
Compound name
2-[2-[(2-hydroxy-3,5-dimethylphenyl)methylideneamino]ethyliminomethyl]-4,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

324.18378 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 179.6
[M+Na]+ 347.17300 187.9
[M-H]- 323.17650 187.1
[M+NH4]+ 342.21760 194.3
[M+K]+ 363.14694 182.9
[M+H-H2O]+ 307.18104 171.3
[M+HCOO]- 369.18198 204.7
[M+CH3COO]- 383.19763 218.5
[M+Na-2H]- 345.15845 180.8
[M]+ 324.18323 183.0
[M]- 324.18433 183.0
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