CID 165766249

2763740-83-4

Structural Information

Molecular Formula
C8H12O3
SMILES
COC(=O)C1CC(C1)OC=C
InChI
InChI=1S/C8H12O3/c1-3-11-7-4-6(5-7)8(9)10-2/h3,6-7H,1,4-5H2,2H3
InChIKey
UQIQXGOIZSJIJA-UHFFFAOYSA-N
Compound name
methyl 3-ethenoxycyclobutane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.07864 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.085916 129.5
[M+Na]+ 179.067858 135.3
[M-H]- 155.071364 133.1
[M+NH4]+ 174.112463 144.1
[M+K]+ 195.041798 138.3
[M+H-H2O]+ 139.075900 119.6
[M+HCOO]- 201.076841 151.1
[M+CH3COO]- 215.092491 180.2
[M+Na-2H]- 177.053306 133.6
[M]+ 156.07809142 139.8
[M]- 156.07918858 139.8
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.