CID 59129882

Mal-peg2-nhs ester

Structural Information

Molecular Formula
C15H18N2O8
SMILES
C1CC(=O)N(C1=O)OC(=O)CCOCCOCCN2C(=O)C=CC2=O
InChI
InChI=1S/C15H18N2O8/c18-11-1-2-12(19)16(11)6-8-24-10-9-23-7-5-15(22)25-17-13(20)3-4-14(17)21/h1-2H,3-10H2
InChIKey
KMEJZQCDHANYJV-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

354.10632 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.11360 174.0
[M+Na]+ 377.09554 180.1
[M-H]- 353.09904 177.9
[M+NH4]+ 372.14014 187.1
[M+K]+ 393.06948 179.4
[M+H-H2O]+ 337.10358 166.4
[M+HCOO]- 399.10452 193.9
[M+CH3COO]- 413.12017 209.5
[M+Na-2H]- 375.08099 171.2
[M]+ 354.10577 180.5
[M]- 354.10687 180.5
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