CID 11688612

Boc-nh-peg4-amine

Structural Information

Molecular Formula
C15H32N2O6
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCN
InChI
InChI=1S/C15H32N2O6/c1-15(2,3)23-14(18)17-5-7-20-9-11-22-13-12-21-10-8-19-6-4-16/h4-13,16H2,1-3H3,(H,17,18)
InChIKey
WCNWLERBLMBSOT-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

211
Patents

336.22604 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.23332 181.7
[M+Na]+ 359.21526 183.5
[M-H]- 335.21876 179.8
[M+NH4]+ 354.25986 194.5
[M+K]+ 375.18920 184.2
[M+H-H2O]+ 319.22330 174.1
[M+HCOO]- 381.22424 203.0
[M+CH3COO]- 395.23989 214.0
[M+Na-2H]- 357.20071 183.7
[M]+ 336.22549 190.2
[M]- 336.22659 190.2
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