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thymol sulfate

Properties

Image

Occurences in reactions

MNX_ID

MNXM161615

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₀H₁₄O₄S

charge

mass

230.06128

reference

InChIKey

NODSEPOUFZPJEQ-UHFFFAOYSA-N

InChI

InChI=1S/C10H14O4S/c1-7(2)9-5-4-8(3)6-10(9)14-15(11,12)13/h4-7H,1-3H3,(H,11,12,13)

SMILES

Cc1ccc(C(C)C)c(OS(=O)(=O)O)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:82911 chebi:82911	thymol sulfate 5-methyl-2-(propan-2-yl)phenyl hydrogen sulfate
hmdb:HMDB0062720	Thymol Sulfate (2-isopropyl-5-methylphenyl)oxidanesulfonic acid Thymol sulfuric acid Thymol sulphate Thymol sulphuric acid [5-methyl-2-(propan-2-yl)phenyl]oxidanesulfonic acid
CHEBI:133663 chebi:133663	thymol sulfate(1-) 5-methyl-2-(propan-2-yl)phenyl sulfate thymol sulfate
hmdb:HMDB62720	secondary/obsolete/fantasy identifier