CID 10582809

76632-23-0

Structural Information

Molecular Formula

SMILES

CC1=NC(=CS1)CO

InChI

InChI=1S/C5H7NOS/c1-4-6-5(2-7)3-8-4/h3,7H,2H2,1H3

InChIKey

KRCIFTBSQKDYMH-UHFFFAOYSA-N

Compound name

(2-methyl-1,3-thiazol-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 398
Patents: 129.02484 Da
Monoisotopic Mass: 0.5
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]+	130.03212	124.1
[M+Na]+	152.01406	135.4
[M+NH4]+	147.05866	133.2
[M+K]+	167.98800	129.6
[M-H]-	128.01756	125.1
[M+Na-2H]-	149.99951	129.1
[M]+	129.02429	126.3
[M]-	129.02539	126.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe