CID 75391

2363-99-7

Structural Information

Molecular Formula

C₂₀H₂₀N₂O

SMILES

CCN(CC)C1=CC=C(C=C1)N=C2C=CC(=O)C3=CC=CC=C23

InChI

InChI=1S/C20H20N2O/c1-3-22(4-2)16-11-9-15(10-12-16)21-19-13-14-20(23)18-8-6-5-7-17(18)19/h5-14H,3-4H2,1-2H3

InChIKey

GFZAEDHEVXNEEA-UHFFFAOYSA-N

Compound name

4-[4-(diethylamino)phenyl]iminonaphthalen-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 304.15756 Da
Monoisotopic Mass: 4.7
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]+	305.164836	172.1
[M+Na]+	327.146778	178.6
[M-H]-	303.150284	181.9
[M+NH4]+	322.191383	188.6
[M+K]+	343.120718	174.4
[M+H-H2O]+	287.154820	162.7
[M+HCOO]-	349.155761	197.3
[M+CH3COO]-	363.171411	216.9
[M+Na-2H]-	325.132226	177.4
[M]+	304.15701142	173.2
[M]-	304.15810858	173.2

Literature stripe

literature stripe

Patent stripe

patents stripe