CID 40408

52514-77-9

Structural Information

Molecular Formula

C₁₅H₁₅NO

SMILES

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

InChI

InChI=1S/C15H15NO/c1-16-14(12-8-4-2-5-9-12)15(17)13-10-6-3-7-11-13/h2-11,14,16H,1H3

InChIKey

HHBQNUTWFDOORZ-UHFFFAOYSA-N

Compound name

2-(methylamino)-1,2-diphenylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 225.11537 Da
Monoisotopic Mass: 2.4
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]+	226.122646	151.2
[M+Na]+	248.104588	156.2
[M-H]-	224.108094	157.5
[M+NH4]+	243.149193	168.3
[M+K]+	264.078528	152.9
[M+H-H2O]+	208.112630	143.5
[M+HCOO]-	270.113571	174.7
[M+CH3COO]-	284.129221	192.8
[M+Na-2H]-	246.090036	156.7
[M]+	225.11482142	149.4
[M]-	225.11591858	149.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe