CID 168447877

2246915-35-3

Structural Information

Molecular Formula
C15H27BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C/2\CCCC(C2)(C)C
InChI
InChI=1S/C15H27BO2/c1-13(2)9-7-8-12(10-13)11-16-17-14(3,4)15(5,6)18-16/h11H,7-10H2,1-6H3/b12-11+
InChIKey
PNLRYXCANKXDDK-VAWYXSNFSA-N
Compound name
2-[(E)-(3,3-dimethylcyclohexylidene)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.2104 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.217676 153.0
[M+Na]+ 273.199618 160.0
[M-H]- 249.203124 160.8
[M+NH4]+ 268.244223 175.9
[M+K]+ 289.173558 160.1
[M+H-H2O]+ 233.207660 149.8
[M+HCOO]- 295.208601 169.3
[M+CH3COO]- 309.224251 194.5
[M+Na-2H]- 271.185066 157.1
[M]+ 250.20985142 152.2
[M]- 250.21094858 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

No patent data available for this compound.