CID 135842464

474762-68-0

Structural Information

Molecular Formula
C17H18N2O5
SMILES
COC1=CC(=C(C=C1)O)/C=N/NC(=O)C2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C17H18N2O5/c1-22-13-5-6-14(20)12(8-13)10-18-19-17(21)11-4-7-15(23-2)16(9-11)24-3/h4-10,20H,1-3H3,(H,19,21)/b18-10+
InChIKey
UDWMADIGCNIFHD-VCHYOVAHSA-N
Compound name
N-[(E)-(2-hydroxy-5-methoxyphenyl)methylideneamino]-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.12158 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.12886 174.6
[M+Na]+ 353.11080 181.5
[M-H]- 329.11430 181.8
[M+NH4]+ 348.15540 188.0
[M+K]+ 369.08474 179.6
[M+H-H2O]+ 313.11884 165.7
[M+HCOO]- 375.11978 200.3
[M+CH3COO]- 389.13543 214.4
[M+Na-2H]- 351.09625 178.0
[M]+ 330.12103 179.7
[M]- 330.12213 179.7
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

No patent data available for this compound.