CID 14742407

129217-85-2

Structural Information

Molecular Formula
C12H23BO2Si
SMILES
B1(OC(C(O1)(C)C)(C)C)CC#C[Si](C)(C)C
InChI
InChI=1S/C12H23BO2Si/c1-11(2)12(3,4)15-13(14-11)9-8-10-16(5,6)7/h9H2,1-7H3
InChIKey
BRINLPZAWWXACQ-UHFFFAOYSA-N
Compound name
trimethyl-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-1-ynyl]silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

238.15604 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.16332 145.3
[M+Na]+ 261.14526 156.3
[M-H]- 237.14876 149.1
[M+NH4]+ 256.18986 165.5
[M+K]+ 277.11920 154.4
[M+H-H2O]+ 221.15330 136.7
[M+HCOO]- 283.15424 158.6
[M+CH3COO]- 297.16989 197.1
[M+Na-2H]- 259.13071 151.2
[M]+ 238.15549 143.9
[M]- 238.15659 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe