CID 165943841

En300-28339259

Structural Information

Molecular Formula
C16H30BNO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C(=C)C(C)(C)NC(=O)OC(C)(C)C
InChI
InChI=1S/C16H30BNO4/c1-11(17-21-15(7,8)16(9,10)22-17)14(5,6)18-12(19)20-13(2,3)4/h1H2,2-10H3,(H,18,19)
InChIKey
ARCODLXSOFQBIA-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-en-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.22678 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.23406 168.2
[M+Na]+ 334.21600 174.0
[M-H]- 310.21950 172.9
[M+NH4]+ 329.26060 186.5
[M+K]+ 350.18994 176.2
[M+H-H2O]+ 294.22404 166.6
[M+HCOO]- 356.22498 183.5
[M+CH3COO]- 370.24063 209.4
[M+Na-2H]- 332.20145 173.4
[M]+ 311.22623 172.9
[M]- 311.22733 172.9
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.