CID 88853548

N-boc-peg4-bromide

Structural Information

Molecular Formula
C15H30BrNO6
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCBr
InChI
InChI=1S/C15H30BrNO6/c1-15(2,3)23-14(18)17-5-7-20-9-11-22-13-12-21-10-8-19-6-4-16/h4-13H2,1-3H3,(H,17,18)
InChIKey
KYOVSWOWVSWAII-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

399.12564 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.13292 189.8
[M+Na]+ 422.11486 186.2
[M+NH4]+ 417.15946 189.7
[M+K]+ 438.08880 187.9
[M-H]- 398.11836 185.0
[M+Na-2H]- 420.10031 186.0
[M]+ 399.12509 186.2
[M]- 399.12619 186.2
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