CID 3610633

150404-18-5

Structural Information

Molecular Formula

C₁₆H₁₅N₂P

SMILES

CN1C=CN=C1P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N2P/c1-18-13-12-17-16(18)19(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13H,1H3

InChIKey

XETUDUREHZVDEM-UHFFFAOYSA-N

Compound name

(1-methylimidazol-2-yl)-diphenylphosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 14
Patents: 266.0973 Da
Monoisotopic Mass: 3.0
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]+	267.10458	161.8
[M+Na]+	289.08652	177.0
[M+NH4]+	284.13112	170.8
[M+K]+	305.06046	170.4
[M-H]-	265.09002	167.5
[M+Na-2H]-	287.07197	172.9
[M]+	266.09675	165.7
[M]-	266.09785	165.7

Literature stripe

literature stripe

Patent stripe

patents stripe