CID 3053661

Brn 0449337

Structural Information

Molecular Formula
C21H24N2O4
SMILES
COC1=CC2=C(C=C1)NC=C2CCNC(=O)CC3=CC(=C(C=C3)OC)OC
InChI
InChI=1S/C21H24N2O4/c1-25-16-5-6-18-17(12-16)15(13-23-18)8-9-22-21(24)11-14-4-7-19(26-2)20(10-14)27-3/h4-7,10,12-13,23H,8-9,11H2,1-3H3,(H,22,24)
InChIKey
JGTZNDHFTVGVOW-UHFFFAOYSA-N
Compound name
2-(3,4-dimethoxyphenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.1736 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.18088 187.9
[M+Na]+ 391.16282 195.3
[M-H]- 367.16632 193.4
[M+NH4]+ 386.20742 200.9
[M+K]+ 407.13676 190.7
[M+H-H2O]+ 351.17086 179.0
[M+HCOO]- 413.17180 209.9
[M+CH3COO]- 427.18745 217.7
[M+Na-2H]- 389.14827 189.9
[M]+ 368.17305 194.1
[M]- 368.17415 194.1
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.