CID 204275

16024-89-8

Structural Information

Molecular Formula

C₁₁H₁₀N₂OS

SMILES

CC1CN2C(=O)C3=CC=CC=C3N=C2S1

InChI

InChI=1S/C11H10N2OS/c1-7-6-13-10(14)8-4-2-3-5-9(8)12-11(13)15-7/h2-5,7H,6H2,1H3

InChIKey

NOFIPOCUDNMRNF-UHFFFAOYSA-N

Compound name

2-methyl-2,3-dihydro-[1,3]thiazolo[2,3-b]quinazolin-5-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 218.05139 Da
Monoisotopic Mass: 2.0
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]+	219.05867	143.8
[M+Na]+	241.04061	155.8
[M-H]-	217.04411	147.6
[M+NH4]+	236.08521	164.9
[M+K]+	257.01455	151.4
[M+H-H2O]+	201.04865	137.7
[M+HCOO]-	263.04959	159.7
[M+CH3COO]-	277.06524	157.5
[M+Na-2H]-	239.02606	148.3
[M]+	218.05084	147.0
[M]-	218.05194	147.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.