CID 13590168

92992-17-1

Structural Information

Molecular Formula

C₁₀H₁₁NO₄

SMILES

COC(=O)C1CCN2C1=C(C=C2)C(=O)O

InChI

InChI=1S/C10H11NO4/c1-15-10(14)7-3-5-11-4-2-6(8(7)11)9(12)13/h2,4,7H,3,5H2,1H3,(H,12,13)

InChIKey

CVBXYEQRFRJNQS-UHFFFAOYSA-N

Compound name

7-methoxycarbonyl-6,7-dihydro-5H-pyrrolizine-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 6
Patents: 209.0688 Da
Monoisotopic Mass: 0.1
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]+	210.076076	144.5
[M+Na]+	232.058018	152.7
[M-H]-	208.061524	147.0
[M+NH4]+	227.102623	165.9
[M+K]+	248.031958	151.5
[M+H-H2O]+	192.066060	139.5
[M+HCOO]-	254.067001	165.1
[M+CH3COO]-	268.082651	182.4
[M+Na-2H]-	230.043466	145.4
[M]+	209.06825142	146.1
[M]-	209.06934858	146.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe