CID 2115

1-naphthyl phosphate

Structural Information

Molecular Formula

C₁₀H₉O₄P

SMILES

C1=CC=C2C(=C1)C=CC=C2OP(=O)(O)O

InChI

InChI=1S/C10H9O4P/c11-15(12,13)14-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,11,12,13)

InChIKey

YNXICDMQCQPQEW-UHFFFAOYSA-N

Compound name

naphthalen-1-yl dihydrogen phosphate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 111
References: 2928
Patents: 224.02385 Da
Monoisotopic Mass: 2.0
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]+	225.03113	145.4
[M+Na]+	247.01307	157.5
[M+NH4]+	242.05767	152.8
[M+K]+	262.98701	152.7
[M-H]-	223.01657	145.7
[M+Na-2H]-	244.99852	151.1
[M]+	224.02330	147.1
[M]-	224.02440	147.1

Literature stripe

literature stripe

Patent stripe

patents stripe