CID 56965735

4-chloro-6,7-dihydro-5h-cyclopenta[b]pyridin-7-ol

Structural Information

Molecular Formula
C8H8ClNO
SMILES
C1CC2=C(C=CN=C2C1O)Cl
InChI
InChI=1S/C8H8ClNO/c9-6-3-4-10-8-5(6)1-2-7(8)11/h3-4,7,11H,1-2H2
InChIKey
OXHBZGCVWSXMNS-UHFFFAOYSA-N
Compound name
4-chloro-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

169.02943 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.036706 131.8
[M+Na]+ 192.018648 142.3
[M-H]- 168.022154 134.0
[M+NH4]+ 187.063253 154.4
[M+K]+ 207.992588 137.8
[M+H-H2O]+ 152.026690 127.0
[M+HCOO]- 214.027631 148.7
[M+CH3COO]- 228.043281 145.8
[M+Na-2H]- 190.004096 137.8
[M]+ 169.02888142 132.2
[M]- 169.02997858 132.2
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