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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.23406 173.1
[M+Na]+ 346.21600 178.6
[M-H]- 322.21950 178.8
[M+NH4]+ 341.26060 191.4
[M+K]+ 362.18994 180.7
[M+H-H2O]+ 306.22404 170.5
[M+HCOO]- 368.22498 190.2
[M+CH3COO]- 382.24063 214.4
[M+Na-2H]- 344.20145 175.5
[M]+ 323.22623 179.2
[M]- 323.22733 179.2
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

No patent data available for this compound.