CID 68285366

1394909-88-6

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

8
Patents

238.17403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.181306 149.5
[M+Na]+ 261.163248 157.9
[M-H]- 237.166754 158.5
[M+NH4]+ 256.207853 169.8
[M+K]+ 277.137188 160.0
[M+H-H2O]+ 221.171290 146.1
[M+HCOO]- 283.172231 166.8
[M+CH3COO]- 297.187881 193.4
[M+Na-2H]- 259.148696 154.4
[M]+ 238.17348142 152.2
[M]- 238.17457858 152.2
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