CID 15836636

212127-74-7

Structural Information

Molecular Formula

C₁₇H₃₀BNO₄

SMILES

B1(OC(C(O1)(C)C)(C)C)C(=C)CN(CC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H30BNO4/c1-10-11-19(14(20)21-15(3,4)5)12-13(2)18-22-16(6,7)17(8,9)23-18/h10H,1-2,11-12H2,3-9H3

InChIKey

CYDRNMYOBOWKOM-UHFFFAOYSA-N

Compound name

tert-butyl N-prop-2-enyl-N-[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: 323.22678 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	324.234056	173.1
[M+Na]+	346.215998	178.6
[M-H]-	322.219504	178.8
[M+NH4]+	341.260603	191.4
[M+K]+	362.189938	180.7
[M+H-H2O]+	306.224040	170.5
[M+HCOO]-	368.224981	190.2
[M+CH3COO]-	382.240631	214.4
[M+Na-2H]-	344.201446	175.5
[M]+	323.22623142	179.2
[M]-	323.22732858	179.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.