CID 9837914

85232-02-6

Structural Information

Molecular Formula

C₉H₂₀NO₅P

SMILES

CCOP(=O)(NC(=O)OC(C)(C)C)OCC

InChI

InChI=1S/C9H20NO5P/c1-6-13-16(12,14-7-2)10-8(11)15-9(3,4)5/h6-7H2,1-5H3,(H,10,11,12)

InChIKey

MJJRHRHTDZXUKY-UHFFFAOYSA-N

Compound name

tert-butyl N-diethoxyphosphorylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 253.10791 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]+	254.11519	157.5
[M+Na]+	276.09713	163.1
[M+NH4]+	271.14173	161.3
[M+K]+	292.07107	161.8
[M-H]-	252.10063	153.1
[M+Na-2H]-	274.08258	157.5
[M]+	253.10736	156.5
[M]-	253.10846	156.5

Literature stripe

literature stripe

Patent stripe

patents stripe