CID 75356182

4-(prop-1-en-2-yl)oxan-4-ol

Structural Information

Molecular Formula
C8H14O2
SMILES
CC(=C)C1(CCOCC1)O
InChI
InChI=1S/C8H14O2/c1-7(2)8(9)3-5-10-6-4-8/h9H,1,3-6H2,2H3
InChIKey
SAOOWKRLMCLCOU-UHFFFAOYSA-N
Compound name
4-prop-1-en-2-yloxan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.09938 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 130.5
[M+Na]+ 165.088598 135.8
[M-H]- 141.092104 132.9
[M+NH4]+ 160.133203 151.7
[M+K]+ 181.062538 136.0
[M+H-H2O]+ 125.096640 126.2
[M+HCOO]- 187.097581 148.2
[M+CH3COO]- 201.113231 170.2
[M+Na-2H]- 163.074046 136.7
[M]+ 142.09883142 126.3
[M]- 142.09992858 126.3
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.