CID 126154

3705-27-9

Structural Information

Molecular Formula

C₇H₁₀N₂O₂

SMILES

C1C[C@H]2C(=O)NCC(=O)N2C1

InChI

InChI=1S/C7H10N2O2/c10-6-4-8-7(11)5-2-1-3-9(5)6/h5H,1-4H2,(H,8,11)/t5-/m0/s1

InChIKey

OWOHLURDBZHNGG-YFKPBYRVSA-N

Compound name

(8aS)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 48
References: 1131
Patents: 154.07423 Da
Monoisotopic Mass: -0.6
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]+	155.08151	132.8
[M+Na]+	177.06345	142.2
[M+NH4]+	172.10805	140.3
[M+K]+	193.03739	139.2
[M-H]-	153.06695	132.0
[M+Na-2H]-	175.04890	134.7
[M]+	154.07368	133.4
[M]-	154.07478	133.4

Literature stripe

literature stripe

Patent stripe

patents stripe