CID 70664641

1398503-71-3

Structural Information

Molecular Formula
C15H21BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC3CC3
InChI
InChI=1S/C15H21BO3/c1-14(2)15(3,4)19-16(18-14)11-5-7-12(8-6-11)17-13-9-10-13/h5-8,13H,9-10H2,1-4H3
InChIKey
OGSNAIXWIZRZLF-UHFFFAOYSA-N
Compound name
2-(4-cyclopropyloxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

260.1584 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.16568 153.2
[M+Na]+ 283.14762 163.3
[M-H]- 259.15112 165.6
[M+NH4]+ 278.19222 168.8
[M+K]+ 299.12156 164.6
[M+H-H2O]+ 243.15566 148.6
[M+HCOO]- 305.15660 173.1
[M+CH3COO]- 319.17225 198.2
[M+Na-2H]- 281.13307 158.9
[M]+ 260.15785 159.9
[M]- 260.15895 159.9
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