CID 2737945

2-thiazoline, 2-((p-methylbenzyl)amino)-

Structural Information

Molecular Formula

C₁₁H₁₄N₂S

SMILES

CC1=CC=C(C=C1)CNC2=NCCS2

InChI

InChI=1S/C11H14N2S/c1-9-2-4-10(5-3-9)8-13-11-12-6-7-14-11/h2-5H,6-8H2,1H3,(H,12,13)

InChIKey

SENJFYMMZYUKHS-UHFFFAOYSA-N

Compound name

N-[(4-methylphenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 1
Patents: 206.08777 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]+	207.09505	144.7
[M+Na]+	229.07699	156.7
[M+NH4]+	224.12159	154.5
[M+K]+	245.05093	148.9
[M-H]-	205.08049	149.4
[M+Na-2H]-	227.06244	152.6
[M]+	206.08722	148.2
[M]-	206.08832	148.2

Literature stripe

literature stripe

Patent stripe

patents stripe