CID 80462790

{4h,6h,7h-pyrano[3,4-d][1,2]oxazol-3-yl}methanol

Structural Information

Molecular Formula
C7H9NO3
SMILES
C1COCC2=C1ON=C2CO
InChI
InChI=1S/C7H9NO3/c9-3-6-5-4-10-2-1-7(5)11-8-6/h9H,1-4H2
InChIKey
HSLPCSVNOFOFKW-UHFFFAOYSA-N
Compound name
6,7-dihydro-4H-pyrano[3,4-d][1,2]oxazol-3-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.05824 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.06552 128.7
[M+Na]+ 178.04746 140.2
[M+NH4]+ 173.09206 137.1
[M+K]+ 194.02140 137.7
[M-H]- 154.05096 131.9
[M+Na-2H]- 176.03291 132.2
[M]+ 155.05769 131.1
[M]- 155.05879 131.1
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.