CID 54683785

6,7-dihydro-5h-cyclopenta[b]pyridine-2,4-diol

Structural Information

Molecular Formula
C8H9NO2
SMILES
C1CC2=C(C1)NC(=O)C=C2O
InChI
InChI=1S/C8H9NO2/c10-7-4-8(11)9-6-3-1-2-5(6)7/h4H,1-3H2,(H2,9,10,11)
InChIKey
SCDZKHFXHRNLQM-UHFFFAOYSA-N
Compound name
4-hydroxy-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
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 127.8
[M+Na]+ 174.05254 137.3
[M-H]- 150.05604 128.9
[M+NH4]+ 169.09714 149.5
[M+K]+ 190.02648 133.7
[M+H-H2O]+ 134.06058 122.7
[M+HCOO]- 196.06152 148.3
[M+CH3COO]- 210.07717 169.0
[M+Na-2H]- 172.03799 133.9
[M]+ 151.06277 125.3
[M]- 151.06387 125.3
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

patents stripe