CID 51437

Ediaemp

Structural Information

Molecular Formula

C₁₁H₂₆NO₃P

SMILES

CCOP(=O)(C)OCCN(C(C)C)C(C)C

InChI

InChI=1S/C11H26NO3P/c1-7-14-16(6,13)15-9-8-12(10(2)3)11(4)5/h10-11H,7-9H2,1-6H3

InChIKey

IEMIPTMSCIDZLN-UHFFFAOYSA-N

Compound name

N-[2-[ethoxy(methyl)phosphoryl]oxyethyl]-N-propan-2-ylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 251.16502 Da
Monoisotopic Mass: 1.5
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]+	252.17230	164.9
[M+Na]+	274.15424	169.2
[M-H]-	250.15774	164.9
[M+NH4]+	269.19884	183.2
[M+K]+	290.12818	171.0
[M+H-H2O]+	234.16228	157.0
[M+HCOO]-	296.16322	191.2
[M+CH3COO]-	310.17887	204.7
[M+Na-2H]-	272.13969	163.7
[M]+	251.16447	172.2
[M]-	251.16557	172.2

Literature stripe

literature stripe

Patent stripe

patents stripe