CID 68465443

959972-40-8

Structural Information

Molecular Formula
C15H23BO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCCOC
InChI
InChI=1S/C15H23BO4/c1-14(2)15(3,4)20-16(19-14)12-6-8-13(9-7-12)18-11-10-17-5/h6-9H,10-11H2,1-5H3
InChIKey
FSGMVMFQGDREIJ-UHFFFAOYSA-N
Compound name
2-[4-(2-methoxyethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

278.16895 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.17623 159.4
[M+Na]+ 301.15817 167.9
[M-H]- 277.16167 167.9
[M+NH4]+ 296.20277 179.2
[M+K]+ 317.13211 168.9
[M+H-H2O]+ 261.16621 154.7
[M+HCOO]- 323.16715 180.2
[M+CH3COO]- 337.18280 199.0
[M+Na-2H]- 299.14362 165.0
[M]+ 278.16840 166.2
[M]- 278.16950 166.2
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

patents stripe