CID 155820618

En300-26981077

Structural Information

Molecular Formula
C23H41B2NO6
SMILES
B1(OC(C(O1)(C)C)(C)C)C(=C)CN(CC(=C)B2OC(C(O2)(C)C)(C)C)C(=O)OC(C)(C)C
InChI
InChI=1S/C23H41B2NO6/c1-16(24-29-20(6,7)21(8,9)30-24)14-26(18(27)28-19(3,4)5)15-17(2)25-31-22(10,11)23(12,13)32-25/h1-2,14-15H2,3-13H3
InChIKey
MNCSFOVPJYMKBI-UHFFFAOYSA-N
Compound name
tert-butyl N,N-bis[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

449.312 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 450.31928 190.8
[M+Na]+ 472.30122 195.9
[M-H]- 448.30472 200.4
[M+NH4]+ 467.34582 206.9
[M+K]+ 488.27516 200.8
[M+H-H2O]+ 432.30926 192.7
[M+HCOO]- 494.31020 202.5
[M+CH3COO]- 508.32585 238.9
[M+Na-2H]- 470.28667 193.2
[M]+ 449.31145 200.2
[M]- 449.31255 200.2
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

No patent data available for this compound.