CID 11086408

372193-91-4

Structural Information

Molecular Formula
C16H23BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=CC=C2CC(=C)C
InChI
InChI=1S/C16H23BO2/c1-12(2)11-13-9-7-8-10-14(13)17-18-15(3,4)16(5,6)19-17/h7-10H,1,11H2,2-6H3
InChIKey
YMVRQJAAHXUQLV-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-[2-(2-methylprop-2-enyl)phenyl]-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.1791 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.18638 156.5
[M+Na]+ 281.16832 164.8
[M-H]- 257.17182 165.0
[M+NH4]+ 276.21292 177.1
[M+K]+ 297.14226 164.3
[M+H-H2O]+ 241.17636 152.2
[M+HCOO]- 303.17730 175.8
[M+CH3COO]- 317.19295 198.0
[M+Na-2H]- 279.15377 160.1
[M]+ 258.17855 159.4
[M]- 258.17965 159.4
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.