CID 54680634

58156-35-7

Structural Information

Molecular Formula
C8H9NO2
SMILES
C1CC2=CC(=CC(=O)N2C1)O
InChI
InChI=1S/C8H9NO2/c10-7-4-6-2-1-3-9(6)8(11)5-7/h4-5,10H,1-3H2
InChIKey
WBGRYVYGUXXQBB-UHFFFAOYSA-N
Compound name
7-hydroxy-2,3-dihydro-1H-indolizin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

7
Patents

151.06332 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.07060 127.1
[M+Na]+ 174.05254 137.0
[M-H]- 150.05604 129.6
[M+NH4]+ 169.09714 149.5
[M+K]+ 190.02648 134.3
[M+H-H2O]+ 134.06058 121.8
[M+HCOO]- 196.06152 149.1
[M+CH3COO]- 210.07717 171.5
[M+Na-2H]- 172.03799 133.7
[M]+ 151.06277 126.4
[M]- 151.06387 126.4
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.