CID 11106616

126688-97-9

Structural Information

Molecular Formula
C12H23BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C/CCCC
InChI
InChI=1S/C12H23BO2/c1-6-7-8-9-10-13-14-11(2,3)12(4,5)15-13/h9-10H,6-8H2,1-5H3/b10-9+
InChIKey
PAOJMGKYYPHNDO-MDZDMXLPSA-N
Compound name
2-[(E)-hex-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

210.17911 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18639 144.8
[M+Na]+ 233.16833 152.6
[M-H]- 209.17183 149.6
[M+NH4]+ 228.21293 167.5
[M+K]+ 249.14227 153.1
[M+H-H2O]+ 193.17637 141.9
[M+HCOO]- 255.17731 164.8
[M+CH3COO]- 269.19296 187.8
[M+Na-2H]- 231.15378 150.6
[M]+ 210.17856 148.8
[M]- 210.17966 148.8
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.