CID 7021798

2748-02-9

Structural Information

Molecular Formula

C₁₀H₂₁NO₂

SMILES

CC(C)C[C@H](C(=O)OC(C)(C)C)N

InChI

InChI=1S/C10H21NO2/c1-7(2)6-8(11)9(12)13-10(3,4)5/h7-8H,6,11H2,1-5H3/t8-/m1/s1

InChIKey

HBEJJYHFTZDAHZ-MRVPVSSYSA-N

Compound name

tert-butyl (2R)-2-amino-4-methylpentanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 1369
Patents: 187.15723 Da
Monoisotopic Mass: 1.9
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]+	188.16451	146.0
[M+Na]+	210.14645	153.0
[M+NH4]+	205.19105	152.1
[M+K]+	226.12039	150.4
[M-H]-	186.14995	143.9
[M+Na-2H]-	208.13190	147.0
[M]+	187.15668	146.0
[M]-	187.15778	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe