CID 71256614

1422655-38-6

Structural Information

Molecular Formula
C14H21BO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)CO)OC
InChI
InChI=1S/C14H21BO4/c1-13(2)14(3,4)19-15(18-13)11-7-6-10(9-16)8-12(11)17-5/h6-8,16H,9H2,1-5H3
InChIKey
BTOQVCRKMJDNPJ-UHFFFAOYSA-N
Compound name
[3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

264.1533 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.16058 154.7
[M+Na]+ 287.14252 164.1
[M-H]- 263.14602 162.4
[M+NH4]+ 282.18712 174.7
[M+K]+ 303.11646 164.4
[M+H-H2O]+ 247.15056 150.8
[M+HCOO]- 309.15150 174.3
[M+CH3COO]- 323.16715 194.9
[M+Na-2H]- 285.12797 159.9
[M]+ 264.15275 159.8
[M]- 264.15385 159.8
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