CID 30988

22194-40-7

Structural Information

Molecular Formula

C₁₀H₂₀N₂O₄

SMILES

CCCC(CC)(COC(=O)N)COC(=O)N

InChI

InChI=1S/C10H20N2O4/c1-3-5-10(4-2,6-15-8(11)13)7-16-9(12)14/h3-7H2,1-2H3,(H2,11,13)(H2,12,14)

InChIKey

XBSXQOUEVBSXEI-UHFFFAOYSA-N

Compound name

[2-(carbamoyloxymethyl)-2-ethylpentyl] carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 232.1423 Da
Monoisotopic Mass: 1.1
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]+	233.14958	154.7
[M+Na]+	255.13152	159.0
[M-H]-	231.13502	153.5
[M+NH4]+	250.17612	171.4
[M+K]+	271.10546	159.1
[M+H-H2O]+	215.13956	148.7
[M+HCOO]-	277.14050	175.8
[M+CH3COO]-	291.15615	194.9
[M+Na-2H]-	253.11697	156.4
[M]+	232.14175	156.1
[M]-	232.14285	156.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe