CID 146049018

4,4,5,5-tetramethyl-2-(3,3,3-trifluoro-2-methylprop-1-en-1-yl)-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C10H16BF3O2
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C(\C)/C(F)(F)F
InChI
InChI=1S/C10H16BF3O2/c1-7(10(12,13)14)6-11-15-8(2,3)9(4,5)16-11/h6H,1-5H3/b7-6+
InChIKey
PTEOQVLNKWOXGX-VOTSOKGWSA-N
Compound name
4,4,5,5-tetramethyl-2-[(E)-3,3,3-trifluoro-2-methylprop-1-enyl]-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.11954 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.12682 143.6
[M+Na]+ 259.10876 152.6
[M-H]- 235.11226 145.0
[M+NH4]+ 254.15336 165.1
[M+K]+ 275.08270 153.3
[M+H-H2O]+ 219.11680 139.3
[M+HCOO]- 281.11774 158.5
[M+CH3COO]- 295.13339 190.6
[M+Na-2H]- 257.09421 148.6
[M]+ 236.11899 142.0
[M]- 236.12009 142.0
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.