CID 68285366

Rac-2-[(2r,6s)-2,6-dimethyl-3,6-dihydro-2h-pyran-4-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C13H23BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C[C@@H](O[C@@H](C2)C)C
InChI
InChI=1S/C13H23BO3/c1-9-7-11(8-10(2)15-9)14-16-12(3,4)13(5,6)17-14/h7,9-10H,8H2,1-6H3/t9-,10+/m0/s1
InChIKey
DBRPBBDCXSNINM-VHSXEESVSA-N
Compound name
2-[(2R,6S)-2,6-dimethyl-3,6-dihydro-2H-pyran-4-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

238.17403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.18131 151.0
[M+Na]+ 261.16325 162.7
[M+NH4]+ 256.20785 162.0
[M+K]+ 277.13719 156.4
[M-H]- 237.16675 158.0
[M+Na-2H]- 259.14870 157.1
[M]+ 238.17348 155.1
[M]- 238.17458 155.1
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

patents stripe