CID 85274

1,3-dioxan-5-ol, 2-ethenyl-, cis-

Structural Information

Molecular Formula
C6H10O3
SMILES
C=CC1OCC(CO1)O
InChI
InChI=1S/C6H10O3/c1-2-6-8-3-5(7)4-9-6/h2,5-7H,1,3-4H2
InChIKey
RCORSHSFJCXHTF-UHFFFAOYSA-N
Compound name
2-ethenyl-1,3-dioxan-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

530
Patents

130.06299 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.07027 124.4
[M+Na]+ 153.05221 130.9
[M-H]- 129.05571 127.8
[M+NH4]+ 148.09681 143.1
[M+K]+ 169.02615 132.3
[M+H-H2O]+ 113.06025 119.6
[M+HCOO]- 175.06119 143.2
[M+CH3COO]- 189.07684 167.2
[M+Na-2H]- 151.03766 132.2
[M]+ 130.06244 122.4
[M]- 130.06354 122.4
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