CID 24832722

92637-74-6

Structural Information

Molecular Formula

C₁₇H₁₄N₄S

SMILES

CN1C2=CC=CC=C2C(=NNC3=NC=CS3)C4=CC=CC=C41

InChI

InChI=1S/C17H14N4S/c1-21-14-8-4-2-6-12(14)16(13-7-3-5-9-15(13)21)19-20-17-18-10-11-22-17/h2-11H,1H3,(H,18,20)

InChIKey

IQKUNVHIAKVMPQ-UHFFFAOYSA-N

Compound name

N-[(10-methylacridin-9-ylidene)amino]-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 306.0939 Da
Monoisotopic Mass: 4.6
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]+	307.101176	165.9
[M+Na]+	329.083118	177.7
[M-H]-	305.086624	174.2
[M+NH4]+	324.127723	183.1
[M+K]+	345.057058	170.7
[M+H-H2O]+	289.091160	157.3
[M+HCOO]-	351.092101	187.4
[M+CH3COO]-	365.107751	178.7
[M+Na-2H]-	327.068566	173.7
[M]+	306.09335142	170.4
[M]-	306.09444858	170.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe