CID 4049030

134029-89-3

Structural Information

Molecular Formula
C19H25NO6
SMILES
COC1=CC(=CC(=C1OC)OC)CNC2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C19H25NO6/c1-21-14-7-12(8-15(22-2)18(14)25-5)11-20-13-9-16(23-3)19(26-6)17(10-13)24-4/h7-10,20H,11H2,1-6H3
InChIKey
CXRVPWLVIASLKP-UHFFFAOYSA-N
Compound name
3,4,5-trimethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.16818 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.17546 184.0
[M+Na]+ 386.15740 192.0
[M-H]- 362.16090 191.5
[M+NH4]+ 381.20200 197.0
[M+K]+ 402.13134 191.3
[M+H-H2O]+ 346.16544 174.9
[M+HCOO]- 408.16638 208.6
[M+CH3COO]- 422.18203 221.7
[M+Na-2H]- 384.14285 185.8
[M]+ 363.16763 195.0
[M]- 363.16873 195.0
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.