CID 3060444

1h-indole-3-acetic acid, 2-methyl-, 2-((2,4-dimethoxyphenyl)methyl)hydrazide

Structural Information

Molecular Formula
C20H23N3O3
SMILES
CC1=C(C2=CC=CC=C2N1)CC(=O)NNCC3=C(C=C(C=C3)OC)OC
InChI
InChI=1S/C20H23N3O3/c1-13-17(16-6-4-5-7-18(16)22-13)11-20(24)23-21-12-14-8-9-15(25-2)10-19(14)26-3/h4-10,21-22H,11-12H2,1-3H3,(H,23,24)
InChIKey
OWYDUNLWCVLJRH-UHFFFAOYSA-N
Compound name
N'-[(2,4-dimethoxyphenyl)methyl]-2-(2-methyl-1H-indol-3-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.17395 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.181226 183.3
[M+Na]+ 376.163168 190.5
[M-H]- 352.166674 189.0
[M+NH4]+ 371.207773 196.7
[M+K]+ 392.137108 185.5
[M+H-H2O]+ 336.171210 174.4
[M+HCOO]- 398.172151 206.6
[M+CH3COO]- 412.187801 217.9
[M+Na-2H]- 374.148616 186.4
[M]+ 353.17340142 187.1
[M]- 353.17449858 187.1
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.