CID 2344996

6-phenoxybenzo[d]thiazol-2-amine

Structural Information

Molecular Formula

C₁₃H₁₀N₂OS

SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)N

InChI

InChI=1S/C13H10N2OS/c14-13-15-11-7-6-10(8-12(11)17-13)16-9-4-2-1-3-5-9/h1-8H,(H2,14,15)

InChIKey

AGCIBKULIKCGAH-UHFFFAOYSA-N

Compound name

6-phenoxy-1,3-benzothiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 63
Patents: 242.05139 Da
Monoisotopic Mass: 4.0
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]+	243.05867	149.3
[M+Na]+	265.04061	164.4
[M+NH4]+	260.08521	159.5
[M+K]+	281.01455	156.2
[M-H]-	241.04411	155.0
[M+Na-2H]-	263.02606	159.0
[M]+	242.05084	153.7
[M]-	242.05194	153.7

Literature stripe

literature stripe

Patent stripe

patents stripe