CID 91358712

Methyl 2-formyloxolane-2-carboxylate

Structural Information

Molecular Formula
C7H10O4
SMILES
COC(=O)C1(CCCO1)C=O
InChI
InChI=1S/C7H10O4/c1-10-6(9)7(5-8)3-2-4-11-7/h5H,2-4H2,1H3
InChIKey
FJCVAWLDPYRGCE-UHFFFAOYSA-N
Compound name
methyl 2-formyloxolane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

158.0579 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.06518 129.7
[M+Na]+ 181.04712 137.0
[M-H]- 157.05062 133.8
[M+NH4]+ 176.09172 152.7
[M+K]+ 197.02106 138.5
[M+H-H2O]+ 141.05516 125.7
[M+HCOO]- 203.05610 152.1
[M+CH3COO]- 217.07175 172.1
[M+Na-2H]- 179.03257 136.0
[M]+ 158.05735 131.3
[M]- 158.05845 131.3
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

patents stripe