CID 132371499

Ethyl 3-methyl-2-methylideneoxolane-3-carboxylate

Structural Information

Molecular Formula
C9H14O3
SMILES
CCOC(=O)C1(CCOC1=C)C
InChI
InChI=1S/C9H14O3/c1-4-11-8(10)9(3)5-6-12-7(9)2/h2,4-6H2,1,3H3
InChIKey
IGLHEBHOCQFYPH-UHFFFAOYSA-N
Compound name
ethyl 3-methyl-2-methylideneoxolane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.0943 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.10158 134.9
[M+Na]+ 193.08352 142.4
[M-H]- 169.08702 139.2
[M+NH4]+ 188.12812 157.9
[M+K]+ 209.05746 143.0
[M+H-H2O]+ 153.09156 131.2
[M+HCOO]- 215.09250 156.5
[M+CH3COO]- 229.10815 177.3
[M+Na-2H]- 191.06897 139.5
[M]+ 170.09375 136.2
[M]- 170.09485 136.2
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.