CID 66718379

1-(pyridin-2-yl)cyclobutan-1-ol

Structural Information

Molecular Formula
C9H11NO
SMILES
C1CC(C1)(C2=CC=CC=N2)O
InChI
InChI=1S/C9H11NO/c11-9(5-3-6-9)8-4-1-2-7-10-8/h1-2,4,7,11H,3,5-6H2
InChIKey
KMJZWCDFXHFBQD-UHFFFAOYSA-N
Compound name
1-pyridin-2-ylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

149.08406 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 128.6
[M+Na]+ 172.07328 135.2
[M-H]- 148.07678 132.7
[M+NH4]+ 167.11788 143.2
[M+K]+ 188.04722 135.9
[M+H-H2O]+ 132.08132 117.9
[M+HCOO]- 194.08226 149.1
[M+CH3COO]- 208.09791 174.7
[M+Na-2H]- 170.05873 137.2
[M]+ 149.08351 134.8
[M]- 149.08461 134.8
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