CID 137964652

[1-(1h-pyrazol-3-yl)cyclobutyl]methanol

Structural Information

Molecular Formula
C8H12N2O
SMILES
C1CC(C1)(CO)C2=CC=NN2
InChI
InChI=1S/C8H12N2O/c11-6-8(3-1-4-8)7-2-5-9-10-7/h2,5,11H,1,3-4,6H2,(H,9,10)
InChIKey
AVHQHTCUNAHUBV-UHFFFAOYSA-N
Compound name
[1-(1H-pyrazol-5-yl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.09496 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.102236 130.9
[M+Na]+ 175.084178 137.0
[M-H]- 151.087684 132.4
[M+NH4]+ 170.128783 145.1
[M+K]+ 191.058118 137.1
[M+H-H2O]+ 135.092220 120.0
[M+HCOO]- 197.093161 149.5
[M+CH3COO]- 211.108811 172.0
[M+Na-2H]- 173.069626 136.9
[M]+ 152.09441142 136.1
[M]- 152.09550858 136.1
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.