CID 79145982

(5-cyclobutyl-1,3-oxazol-4-yl)methanol

Structural Information

Molecular Formula
C8H11NO2
SMILES
C1CC(C1)C2=C(N=CO2)CO
InChI
InChI=1S/C8H11NO2/c10-4-7-8(11-5-9-7)6-2-1-3-6/h5-6,10H,1-4H2
InChIKey
GVZSGLRTLJXRMS-UHFFFAOYSA-N
Compound name
(5-cyclobutyl-1,3-oxazol-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07898 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.086256 124.0
[M+Na]+ 176.068198 130.3
[M-H]- 152.071704 128.7
[M+NH4]+ 171.112803 137.1
[M+K]+ 192.042138 132.9
[M+H-H2O]+ 136.076240 113.3
[M+HCOO]- 198.077181 144.7
[M+CH3COO]- 212.092831 175.3
[M+Na-2H]- 174.053646 130.0
[M]+ 153.07843142 132.5
[M]- 153.07952858 132.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.