CID 135433746

113975-75-0

Structural Information

Molecular Formula
C11H10N2O3
SMILES
COC(=O)/C(=N\O)/C1=CNC2=CC=CC=C21
InChI
InChI=1S/C11H10N2O3/c1-16-11(14)10(13-15)8-6-12-9-5-3-2-4-7(8)9/h2-6,12,15H,1H3/b13-10-
InChIKey
GTPFAXDSMSVVGQ-RAXLEYEMSA-N
Compound name
methyl (2Z)-2-hydroxyimino-2-(1H-indol-3-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.06914 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07642 144.9
[M+Na]+ 241.05836 153.3
[M-H]- 217.06186 147.4
[M+NH4]+ 236.10296 163.8
[M+K]+ 257.03230 150.5
[M+H-H2O]+ 201.06640 138.3
[M+HCOO]- 263.06734 168.2
[M+CH3COO]- 277.08299 185.5
[M+Na-2H]- 239.04381 150.7
[M]+ 218.06859 146.3
[M]- 218.06969 146.3
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.