CID 45089947

84348-41-4

Structural Information

Molecular Formula

C₇H₁₁NO₂

SMILES

COC(=O)[C@@H]1CC(=C)CN1

InChI

InChI=1S/C7H11NO2/c1-5-3-6(8-4-5)7(9)10-2/h6,8H,1,3-4H2,2H3/t6-/m0/s1

InChIKey

LJGDVVRRCYVQKF-LURJTMIESA-N

Compound name

methyl (2S)-4-methylidenepyrrolidine-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 102
Patents: 141.07898 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]+	142.08626	131.2
[M+Na]+	164.06820	140.0
[M+NH4]+	159.11280	138.3
[M+K]+	180.04214	137.4
[M-H]-	140.07170	130.2
[M+Na-2H]-	162.05365	133.8
[M]+	141.07843	131.7
[M]-	141.07953	131.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe