CID 45116029

73462-80-3

Structural Information

Molecular Formula

C₈H₁₄N₂O₂

SMILES

CC(=O)N1CCC[C@@H]1C(=O)NC

InChI

InChI=1S/C8H14N2O2/c1-6(11)10-5-3-4-7(10)8(12)9-2/h7H,3-5H2,1-2H3,(H,9,12)/t7-/m1/s1

InChIKey

DPDXFAYSYVRXMF-SSDOTTSWSA-N

Compound name

(2R)-1-acetyl-N-methylpyrrolidine-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 170.10553 Da
Monoisotopic Mass: -1.2
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]+	171.11281	139.0
[M+Na]+	193.09475	146.5
[M+NH4]+	188.13935	145.6
[M+K]+	209.06869	144.6
[M-H]-	169.09825	138.5
[M+Na-2H]-	191.08020	141.3
[M]+	170.10498	139.3
[M]-	170.10608	139.3

Literature stripe

literature stripe

Patent stripe

patents stripe