CID 4348876

P-tolyl selenide

Structural Information

Molecular Formula

C₁₄H₁₄Se

SMILES

CC1=CC=C(C=C1)[Se]C2=CC=C(C=C2)C

InChI

InChI=1S/C14H14Se/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h3-10H,1-2H3

InChIKey

OAJSCXNYCHQGTF-UHFFFAOYSA-N

Compound name

1-methyl-4-(4-methylphenyl)selanylbenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 262.02606 Da
Monoisotopic Mass: None
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]+	263.03334	154.2
[M+Na]+	285.01528	170.6
[M+NH4]+	280.05988	164.6
[M+K]+	300.98922	160.5
[M-H]-	261.01878	160.4
[M+Na-2H]-	283.00073	164.8
[M]+	262.02551	158.7
[M]-	262.02661	158.7

Literature stripe

literature stripe

Patent stripe

patents stripe