CID 19369009

Tert-butyl n-(2-hydroxypropyl)-n-methylcarbamate

Structural Information

Molecular Formula

C₉H₁₉NO₃

SMILES

CC(CN(C)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C9H19NO3/c1-7(11)6-10(5)8(12)13-9(2,3)4/h7,11H,6H2,1-5H3

InChIKey

ROQKPIPQWREQCV-UHFFFAOYSA-N

Compound name

tert-butyl N-(2-hydroxypropyl)-N-methylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 189.13649 Da
Monoisotopic Mass: 0.9
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]+	190.14377	144.2
[M+Na]+	212.12571	151.3
[M+NH4]+	207.17031	150.1
[M+K]+	228.09965	149.2
[M-H]-	188.12921	141.9
[M+Na-2H]-	210.11116	145.6
[M]+	189.13594	144.2
[M]-	189.13704	144.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe