CID 89350

20561-09-5

Structural Information

Molecular Formula
C9H14O4
SMILES
CCOC(=O)C1CC1C(=O)OCC
InChI
InChI=1S/C9H14O4/c1-3-12-8(10)6-5-7(6)9(11)13-4-2/h6-7H,3-5H2,1-2H3
InChIKey
SXLDHZFJMXLFJU-UHFFFAOYSA-N
Compound name
diethyl cyclopropane-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

260
Patents

186.0892 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.096476 140.7
[M+Na]+ 209.078418 149.7
[M-H]- 185.081924 145.5
[M+NH4]+ 204.123023 156.0
[M+K]+ 225.052358 148.5
[M+H-H2O]+ 169.086460 134.9
[M+HCOO]- 231.087401 163.2
[M+CH3COO]- 245.103051 185.6
[M+Na-2H]- 207.063866 143.8
[M]+ 186.08865142 147.7
[M]- 186.08974858 147.7
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