CID 22594387

3-ethynyltetrahydrofuran

Structural Information

Molecular Formula
C6H8O
SMILES
C#CC1CCOC1
InChI
InChI=1S/C6H8O/c1-2-6-3-4-7-5-6/h1,6H,3-5H2
InChIKey
YHAJZHXJKUOHJZ-UHFFFAOYSA-N
Compound name
3-ethynyloxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

138
Patents

96.05752 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 97.064796 119.0
[M+Na]+ 119.04674 129.7
[M+NH4]+ 114.09134 124.7
[M+K]+ 135.02068 122.8
[M-H]- 95.050244 113.6
[M+Na-2H]- 117.03219 121.2
[M]+ 96.056971 118.1
[M]- 96.058069 118.1
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

patents stripe