CID 165491504

En300-1155571

Structural Information

Molecular Formula
C13H23BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC23CCCOC3
InChI
InChI=1S/C13H23BO3/c1-11(2)12(3,4)17-14(16-11)10-8-13(10)6-5-7-15-9-13/h10H,5-9H2,1-4H3
InChIKey
GZLINUYIQXHIND-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(5-oxaspiro[2.5]octan-2-yl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.17403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.18131 149.6
[M+Na]+ 261.16325 158.2
[M-H]- 237.16675 160.8
[M+NH4]+ 256.20785 166.5
[M+K]+ 277.13719 162.2
[M+H-H2O]+ 221.17129 146.2
[M+HCOO]- 283.17223 163.9
[M+CH3COO]- 297.18788 162.7
[M+Na-2H]- 259.14870 156.4
[M]+ 238.17348 153.0
[M]- 238.17458 153.0
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.