CID 15409

1633-40-5

Structural Information

Molecular Formula

C₁₆H₁₇NO

SMILES

CN(C)C(C1=CC=CC=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO/c1-17(2)15(13-9-5-3-6-10-13)16(18)14-11-7-4-8-12-14/h3-12,15H,1-2H3

InChIKey

FFXYYGZTOUQTBO-UHFFFAOYSA-N

Compound name

2-(dimethylamino)-1,2-diphenylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 239.13101 Da
Monoisotopic Mass: 2.9
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]+	240.138286	155.8
[M+Na]+	262.120228	160.5
[M-H]-	238.123734	163.3
[M+NH4]+	257.164833	173.0
[M+K]+	278.094168	158.4
[M+H-H2O]+	222.128270	147.7
[M+HCOO]-	284.129211	179.4
[M+CH3COO]-	298.144861	199.3
[M+Na-2H]-	260.105676	160.0
[M]+	239.13046142	155.6
[M]-	239.13155858	155.6

Literature stripe

literature stripe

Patent stripe

patents stripe