CID 9815621

N-boc-1-amino-3-methylbutan-2-ol

Structural Information

Molecular Formula

C₁₀H₂₁NO₃

SMILES

CC(C)C(CNC(=O)OC(C)(C)C)O

InChI

InChI=1S/C10H21NO3/c1-7(2)8(12)6-11-9(13)14-10(3,4)5/h7-8,12H,6H2,1-5H3,(H,11,13)

InChIKey

JQFVBIVPRMDXCY-UHFFFAOYSA-N

Compound name

tert-butyl N-(2-hydroxy-3-methylbutyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 203.15215 Da
Monoisotopic Mass: 1.6
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]+	204.15943	149.1
[M+Na]+	226.14137	155.3
[M+NH4]+	221.18597	154.3
[M+K]+	242.11531	153.3
[M-H]-	202.14487	146.1
[M+Na-2H]-	224.12682	149.5
[M]+	203.15160	148.6
[M]-	203.15270	148.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe