CID 72941639

Methylsilanol pca

Structural Information

Molecular Formula

C₆H₁₁NO₅Si

SMILES

C[Si](O)(O)OC(=O)[C@@H]1CCC(=O)N1

InChI

InChI=1S/C6H11NO5Si/c1-13(10,11)12-6(9)4-2-3-5(8)7-4/h4,10-11H,2-3H2,1H3,(H,7,8)/t4-/m0/s1

InChIKey

VOPVRRNGCBEXNL-BYPYZUCNSA-N

Compound name

[dihydroxy(methyl)silyl] (2S)-5-oxopyrrolidine-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 1318
Patents: 205.04065 Da
Monoisotopic Mass: None
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]+	206.04793	140.9
[M+Na]+	228.02987	146.9
[M-H]-	204.03337	138.8
[M+NH4]+	223.07447	158.5
[M+K]+	244.00381	145.7
[M+H-H2O]+	188.03791	136.0
[M+HCOO]-	250.03885	156.8
[M+CH3COO]-	264.05450	171.6
[M+Na-2H]-	226.01532	143.5
[M]+	205.04010	137.7
[M]-	205.04120	137.7

Literature stripe

literature stripe

Patent stripe

patents stripe