CID 165649736

1165450-64-5

Structural Information

Molecular Formula
C10H15BrO4
SMILES
CCOC(=O)C1(C[C@H]1CBr)C(=O)OCC
InChI
InChI=1S/C10H15BrO4/c1-3-14-8(12)10(5-7(10)6-11)9(13)15-4-2/h7H,3-6H2,1-2H3/t7-/m0/s1
InChIKey
HSBWSMSYVIEDQU-ZETCQYMHSA-N
Compound name
diethyl (2R)-2-(bromomethyl)cyclopropane-1,1-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.01538 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.02266 154.4
[M+Na]+ 301.00460 166.7
[M-H]- 277.00810 161.5
[M+NH4]+ 296.04920 171.6
[M+K]+ 316.97854 156.7
[M+H-H2O]+ 261.01264 155.0
[M+HCOO]- 323.01358 173.7
[M+CH3COO]- 337.02923 197.2
[M+Na-2H]- 298.99005 159.2
[M]+ 278.01483 179.3
[M]- 278.01593 179.3
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

No patent data available for this compound.