CID 155973507

2-(3-((2,2-dimethyl-1,3-dioxolan-4-yl)methoxy)prop-1-en-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C15H27BO5
SMILES
B1(OC(C(O1)(C)C)(C)C)C(=C)COCC2COC(O2)(C)C
InChI
InChI=1S/C15H27BO5/c1-11(16-20-13(2,3)14(4,5)21-16)8-17-9-12-10-18-15(6,7)19-12/h12H,1,8-10H2,2-7H3
InChIKey
VCBDINNEKGGYKD-UHFFFAOYSA-N
Compound name
2-[3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]prop-1-en-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.19516 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.20244 161.0
[M+Na]+ 321.18438 168.2
[M-H]- 297.18788 169.9
[M+NH4]+ 316.22898 180.6
[M+K]+ 337.15832 171.6
[M+H-H2O]+ 281.19242 160.3
[M+HCOO]- 343.19336 176.8
[M+CH3COO]- 357.20901 203.2
[M+Na-2H]- 319.16983 165.4
[M]+ 298.19461 167.5
[M]- 298.19571 167.5
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.