CID 102878

2783-48-4

Structural Information

Molecular Formula

C₁₄H₂₃O₃P

SMILES

CCC(C)OP(=O)(C1=CC=CC=C1)OC(C)CC

InChI

InChI=1S/C14H23O3P/c1-5-12(3)16-18(15,17-13(4)6-2)14-10-8-7-9-11-14/h7-13H,5-6H2,1-4H3

InChIKey

LVHRUHVOYXWOMW-UHFFFAOYSA-N

Compound name

di(butan-2-yloxy)phosphorylbenzene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 4
Patents: 270.1385 Da
Monoisotopic Mass: 3.7
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]+	271.14578	164.2
[M+Na]+	293.12772	174.0
[M+NH4]+	288.17232	170.6
[M+K]+	309.10166	169.1
[M-H]-	269.13122	164.2
[M+Na-2H]-	291.11317	168.4
[M]+	270.13795	165.4
[M]-	270.13905	165.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe