CID 1514454

199175-10-5

Structural Information

Molecular Formula

C₁₀H₂₀N₂O₂

SMILES

CC(C)(C)OC(=O)N1CC[C@H](C1)CN

InChI

InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h8H,4-7,11H2,1-3H3/t8-/m0/s1

InChIKey

OGCCBDIYOAFOGK-QMMMGPOBSA-N

Compound name

tert-butyl (3S)-3-(aminomethyl)pyrrolidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1322
Patents: 200.15248 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]+	201.15976	147.5
[M+Na]+	223.14170	154.4
[M+NH4]+	218.18630	153.8
[M+K]+	239.11564	152.9
[M-H]-	199.14520	146.6
[M+Na-2H]-	221.12715	149.3
[M]+	200.15193	147.8
[M]-	200.15303	147.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe