CID 152438

22102-92-7

Structural Information

Molecular Formula

C₁₀H₁₅NO₄

SMILES

CCCCCC(=O)ON1C(=O)CCC1=O

InChI

InChI=1S/C10H15NO4/c1-2-3-4-5-10(14)15-11-8(12)6-7-9(11)13/h2-7H2,1H3

InChIKey

HNYAWMSQSBERBE-UHFFFAOYSA-N

Compound name

(2,5-dioxopyrrolidin-1-yl) hexanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 627
Patents: 213.10011 Da
Monoisotopic Mass: 1.1
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]+	214.10739	148.5
[M+Na]+	236.08933	156.8
[M+NH4]+	231.13393	154.0
[M+K]+	252.06327	154.4
[M-H]-	212.09283	146.7
[M+Na-2H]-	234.07478	149.7
[M]+	213.09956	148.6
[M]-	213.10066	148.6

Literature stripe

literature stripe

Patent stripe

patents stripe