CID 211767

Brn 2884199

Structural Information

Molecular Formula
C20H20N2O3
SMILES
COC1=CC(=CC(=C1OC)OC)N=C(C2=CC=CC3=CC=CC=C32)N
InChI
InChI=1S/C20H20N2O3/c1-23-17-11-14(12-18(24-2)19(17)25-3)22-20(21)16-10-6-8-13-7-4-5-9-15(13)16/h4-12H,1-3H3,(H2,21,22)
InChIKey
KLNGRJQWGQETQN-UHFFFAOYSA-N
Compound name
N'-(3,4,5-trimethoxyphenyl)naphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.1474 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.15468 179.6
[M+Na]+ 359.13662 187.0
[M-H]- 335.14012 188.3
[M+NH4]+ 354.18122 194.1
[M+K]+ 375.11056 183.6
[M+H-H2O]+ 319.14466 170.2
[M+HCOO]- 381.14560 204.3
[M+CH3COO]- 395.16125 219.9
[M+Na-2H]- 357.12207 183.9
[M]+ 336.14685 183.3
[M]- 336.14795 183.3
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.