CID 4618600

11-maleimidoundecanoic acid

Structural Information

Molecular Formula

C₁₅H₂₃NO₄

SMILES

C1=CC(=O)N(C1=O)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C15H23NO4/c17-13-10-11-14(18)16(13)12-8-6-4-2-1-3-5-7-9-15(19)20/h10-11H,1-9,12H2,(H,19,20)

InChIKey

UVZTZBRGZXIBLZ-UHFFFAOYSA-N

Compound name

11-(2,5-dioxopyrrol-1-yl)undecanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 436
Patents: 281.16272 Da
Monoisotopic Mass: 3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	282.17000	169.2
[M+Na]+	304.15194	176.7
[M+NH4]+	299.19654	173.4
[M+K]+	320.12588	173.3
[M-H]-	280.15544	166.8
[M+Na-2H]-	302.13739	169.4
[M]+	281.16217	168.9
[M]-	281.16327	168.9

Literature stripe

literature stripe

Patent stripe

patents stripe