CID 460598

1-morpholinomethyl-3-phenoxyocetylhydrazono-2-indolinone

Structural Information

Molecular Formula
C21H22N4O4
SMILES
C1COCCN1CN2C3=CC=CC=C3C(=C2O)N=NC(=O)COC4=CC=CC=C4
InChI
InChI=1S/C21H22N4O4/c26-19(14-29-16-6-2-1-3-7-16)22-23-20-17-8-4-5-9-18(17)25(21(20)27)15-24-10-12-28-13-11-24/h1-9,27H,10-15H2
InChIKey
JDBDVIIXHHOMSE-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-1-(morpholin-4-ylmethyl)indol-3-yl]imino-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.1641 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.17138 190.5
[M+Na]+ 417.15332 195.6
[M-H]- 393.15682 200.0
[M+NH4]+ 412.19792 199.5
[M+K]+ 433.12726 192.8
[M+H-H2O]+ 377.16136 178.9
[M+HCOO]- 439.16230 211.3
[M+CH3COO]- 453.17795 199.8
[M+Na-2H]- 415.13877 194.6
[M]+ 394.16355 192.5
[M]- 394.16465 192.5
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.