CID 170901805

2639876-15-4

Structural Information

Molecular Formula
C24H47B2NO7
SMILES
B1(OC(C(O1)(C)C)(C)C)CC(B2OC(C(O2)(C)C)(C)C)CCCCN(C(=O)OC(C)(C)C)OC
InChI
InChI=1S/C24H47B2NO7/c1-20(2,3)30-19(28)27(29-12)16-14-13-15-18(26-33-23(8,9)24(10,11)34-26)17-25-31-21(4,5)22(6,7)32-25/h18H,13-17H2,1-12H3
InChIKey
PGVVTVMNAWDCFY-UHFFFAOYSA-N
Compound name
tert-butyl N-[5,6-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hexyl]-N-methoxycarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

483.35385 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 484.36113 200.8
[M+Na]+ 506.34307 204.2
[M+NH4]+ 501.38767 208.5
[M+K]+ 522.31701 201.4
[M-H]- 482.34657 204.4
[M+Na-2H]- 504.32852 203.9
[M]+ 483.35330 202.7
[M]- 483.35440 202.7
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.