CID 9907977

219488-97-8

Structural Information

Molecular Formula
C26H27BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H27BO2/c1-25(2)26(3,4)29-27(28-25)24(22-18-12-7-13-19-22)23(20-14-8-5-9-15-20)21-16-10-6-11-17-21/h5-19H,1-4H3
InChIKey
SBJDOWNOTSFHCV-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(1,2,2-triphenylethenyl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

382.21042 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.21770 195.2
[M+Na]+ 405.19964 200.8
[M-H]- 381.20314 208.8
[M+NH4]+ 400.24424 209.0
[M+K]+ 421.17358 197.9
[M+H-H2O]+ 365.20768 186.2
[M+HCOO]- 427.20862 212.6
[M+CH3COO]- 441.22427 205.3
[M+Na-2H]- 403.18509 195.7
[M]+ 382.20987 194.8
[M]- 382.21097 194.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe