CID 9575555

Benzenecarboximidamide, 3,5-dimethoxy-n'-[(1-naphthalenylcarbonyl)oxy]-

Structural Information

Molecular Formula
C20H18N2O4
SMILES
COC1=CC(=CC(=C1)/C(=N\OC(=O)C2=CC=CC3=CC=CC=C32)/N)OC
InChI
InChI=1S/C20H18N2O4/c1-24-15-10-14(11-16(12-15)25-2)19(21)22-26-20(23)18-9-5-7-13-6-3-4-8-17(13)18/h3-12H,1-2H3,(H2,21,22)
InChIKey
JWIGBXLSYICRHE-UHFFFAOYSA-N
Compound name
[(E)-[amino-(3,5-dimethoxyphenyl)methylidene]amino] naphthalene-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

350.12665 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.13393 181.4
[M+Na]+ 373.11587 187.6
[M-H]- 349.11937 189.8
[M+NH4]+ 368.16047 194.8
[M+K]+ 389.08981 184.9
[M+H-H2O]+ 333.12391 171.8
[M+HCOO]- 395.12485 205.4
[M+CH3COO]- 409.14050 220.4
[M+Na-2H]- 371.10132 185.4
[M]+ 350.12610 184.7
[M]- 350.12720 184.7
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

No patent data available for this compound.