CID 1534

1121-91-1

Structural Information

Molecular Formula

C₅H₁₀N₂S

SMILES

CC1CCN=C(S1)N

InChI

InChI=1S/C5H10N2S/c1-4-2-3-7-5(6)8-4/h4H,2-3H2,1H3,(H2,6,7)

InChIKey

BATVOUKHGLKDGQ-UHFFFAOYSA-N

Compound name

6-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 54
References: 374
Patents: 130.05647 Da
Monoisotopic Mass: 0.6
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]+	131.06375	123.7
[M+Na]+	153.04569	131.1
[M-H]-	129.04919	125.6
[M+NH4]+	148.09029	144.6
[M+K]+	169.01963	129.1
[M+H-H2O]+	113.05373	117.8
[M+HCOO]-	175.05467	140.4
[M+CH3COO]-	189.07032	171.6
[M+Na-2H]-	151.03114	127.2
[M]+	130.05592	120.6
[M]-	130.05702	120.6

Literature stripe

literature stripe

Patent stripe

patents stripe