CID 156071492

3-ethynyl-3-methyloxolane

Structural Information

Molecular Formula
C7H10O
SMILES
CC1(CCOC1)C#C
InChI
InChI=1S/C7H10O/c1-3-7(2)4-5-8-6-7/h1H,4-6H2,2H3
InChIKey
HRKFINIUELMBSJ-UHFFFAOYSA-N
Compound name
3-ethynyl-3-methyloxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

110.073166 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.08044 120.7
[M+Na]+ 133.06238 131.4
[M+NH4]+ 128.10699 127.6
[M+K]+ 149.03632 123.0
[M-H]- 109.06589 115.3
[M+Na-2H]- 131.04783 124.2
[M]+ 110.07262 120.0
[M]- 110.07371 120.0
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