CID 1104571

4-morpholineacetic acid, (5-bromo-2-oxo-3-indolinylidene)hydrazide, (z)-

Structural Information

Molecular Formula
C14H15BrN4O3
SMILES
C1COCCN1CC(=O)N=NC2=C(NC3=C2C=C(C=C3)Br)O
InChI
InChI=1S/C14H15BrN4O3/c15-9-1-2-11-10(7-9)13(14(21)16-11)18-17-12(20)8-19-3-5-22-6-4-19/h1-2,7,16,21H,3-6,8H2
InChIKey
DUWXSCULAGXYDP-UHFFFAOYSA-N
Compound name
N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]-2-morpholin-4-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.03275 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.04003 173.5
[M+Na]+ 389.02197 182.8
[M-H]- 365.02547 181.3
[M+NH4]+ 384.06657 187.7
[M+K]+ 404.99591 172.2
[M+H-H2O]+ 349.03001 170.4
[M+HCOO]- 411.03095 191.5
[M+CH3COO]- 425.04660 212.1
[M+Na-2H]- 387.00742 179.1
[M]+ 366.03220 191.3
[M]- 366.03330 191.3
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.