CID 96630718

2-(2-oxo-2,3-dihydro-1h-indol-3-ylidene)acetaldehyde

Structural Information

Molecular Formula
C10H7NO2
SMILES
C1=CC=C2C(=C1)/C(=C\C=O)/C(=O)N2
InChI
InChI=1S/C10H7NO2/c12-6-5-8-7-3-1-2-4-9(7)11-10(8)13/h1-6H,(H,11,13)/b8-5+
InChIKey
SZPUXQUHQPTPDC-VMPITWQZSA-N
Compound name
(2E)-2-(2-oxo-1H-indol-3-ylidene)acetaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.04768 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.05496 135.9
[M+Na]+ 196.03690 147.9
[M+NH4]+ 191.08150 143.8
[M+K]+ 212.01084 143.2
[M-H]- 172.04040 136.3
[M+Na-2H]- 194.02235 140.3
[M]+ 173.04713 137.5
[M]- 173.04823 137.5
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.