CID 90315932

1505515-74-1

Structural Information

Molecular Formula
C19H30BNO5
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCCNC(=O)OC(C)(C)C
InChI
InChI=1S/C19H30BNO5/c1-17(2,3)24-16(22)21-12-13-23-15-10-8-14(9-11-15)20-25-18(4,5)19(6,7)26-20/h8-11H,12-13H2,1-7H3,(H,21,22)
InChIKey
NGKGVDKSWLOSRW-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

363.2217 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.22898 183.3
[M+Na]+ 386.21092 191.8
[M+NH4]+ 381.25552 191.1
[M+K]+ 402.18486 186.7
[M-H]- 362.21442 187.1
[M+Na-2H]- 384.19637 188.8
[M]+ 363.22115 185.7
[M]- 363.22225 185.7
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

patents stripe