CID 155973821

Ethyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,1'-bi(cyclopropane)]-2-carboxylate

Structural Information

Molecular Formula
C15H25BO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C2C(C2C(=O)OCC)C3CC3
InChI
InChI=1S/C15H25BO4/c1-6-18-13(17)11-10(9-7-8-9)12(11)16-19-14(2,3)15(4,5)20-16/h9-12H,6-8H2,1-5H3
InChIKey
NCVQUOXJXLWUEN-UHFFFAOYSA-N
Compound name
ethyl 2-cyclopropyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1846 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.19188 144.5
[M+Na]+ 303.17382 156.3
[M+NH4]+ 298.21842 154.4
[M+K]+ 319.14776 154.9
[M-H]- 279.17732 161.6
[M+Na-2H]- 301.15927 155.3
[M]+ 280.18405 153.3
[M]- 280.18515 153.3
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.