CID 15663323

Indole-3-acetaldoxime n-oxide

Structural Information

Molecular Formula
C10H10N2O2
SMILES
C1=CC=C2C(=C1)C(=CN2)C/C=[N+](/O)\[O-]
InChI
InChI=1S/C10H10N2O2/c13-12(14)6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,6-7,11H,5H2,(H,13,14)
InChIKey
LZEDEUNADWSJKX-UHFFFAOYSA-N
Compound name
N-hydroxy-2-(1H-indol-3-yl)ethanimine oxide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

190.07423 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.081506 137.4
[M+Na]+ 213.063448 145.4
[M-H]- 189.066954 138.5
[M+NH4]+ 208.108053 156.5
[M+K]+ 229.037388 136.9
[M+H-H2O]+ 173.071490 136.0
[M+HCOO]- 235.072431 160.6
[M+CH3COO]- 249.088081 170.5
[M+Na-2H]- 211.048896 146.5
[M]+ 190.07368142 134.5
[M]- 190.07477858 134.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.