CID 44629855

920304-57-0

Structural Information

Molecular Formula
C16H26BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N(CC)CC
InChI
InChI=1S/C16H26BNO2/c1-7-18(8-2)14-11-9-13(10-12-14)17-19-15(3,4)16(5,6)20-17/h9-12H,7-8H2,1-6H3
InChIKey
WVPMYKCIKQQJIV-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

275.20566 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.21294 163.5
[M+Na]+ 298.19488 175.0
[M+NH4]+ 293.23948 174.5
[M+K]+ 314.16882 167.4
[M-H]- 274.19838 170.4
[M+Na-2H]- 296.18033 171.5
[M]+ 275.20511 167.5
[M]- 275.20621 167.5
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

patents stripe