CID 64985698

(3-cyclobutyl-1,2,4-oxadiazol-5-yl)methanol

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1CC(C1)C2=NOC(=N2)CO
InChI
InChI=1S/C7H10N2O2/c10-4-6-8-7(9-11-6)5-2-1-3-5/h5,10H,1-4H2
InChIKey
BLOUCAGYHVSFFG-UHFFFAOYSA-N
Compound name
(3-cyclobutyl-1,2,4-oxadiazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

154.07423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 124.2
[M+Na]+ 177.063448 131.0
[M-H]- 153.066954 127.6
[M+NH4]+ 172.108053 136.0
[M+K]+ 193.037388 133.7
[M+H-H2O]+ 137.071490 112.6
[M+HCOO]- 199.072431 143.9
[M+CH3COO]- 213.088081 175.1
[M+Na-2H]- 175.048896 130.5
[M]+ 154.07368142 132.9
[M]- 154.07477858 132.9
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