CID 150946

3-methyleneoxindole

Structural Information

Molecular Formula
C9H7NO
SMILES
C=C1C2=CC=CC=C2NC1=O
InChI
InChI=1S/C9H7NO/c1-6-7-4-2-3-5-8(7)10-9(6)11/h2-5H,1H2,(H,10,11)
InChIKey
IGXUUWYVUGBMFT-UHFFFAOYSA-N
Compound name
3-methylidene-1H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

13
References

242
Patents

145.05276 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.06004 128.6
[M+Na]+ 168.04198 141.2
[M+NH4]+ 163.08658 137.5
[M+K]+ 184.01592 136.3
[M-H]- 144.04548 129.8
[M+Na-2H]- 166.02743 133.9
[M]+ 145.05221 130.5
[M]- 145.05331 130.5
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

patents stripe