CID 57448377

2-chloro-5-methylthiazolo[5,4-b]pyridine

Structural Information

Molecular Formula

C₇H₅ClN₂S

SMILES

CC1=NC2=C(C=C1)N=C(S2)Cl

InChI

InChI=1S/C7H5ClN2S/c1-4-2-3-5-6(9-4)11-7(8)10-5/h2-3H,1H3

InChIKey

IHVAUNPEEBBIOG-UHFFFAOYSA-N

Compound name

2-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 183.98619 Da
Monoisotopic Mass: 3.0
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]+	184.99347	132.9
[M+Na]+	206.97541	148.8
[M+NH4]+	202.02001	143.4
[M+K]+	222.94935	140.5
[M-H]-	182.97891	135.5
[M+Na-2H]-	204.96086	140.3
[M]+	183.98564	136.8
[M]-	183.98674	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe