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mass spectrometry (MS)

URL: https://www.chemotion-repository.net/inchikey/PFQIXBDZPIDCQY-CMDGGOBGSA-N/CHMO0000470

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C13H16O5S/c1-11(10-13(14)17-2)18-19(15,16)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
SMILES	COC(=O)CC(OS(=O)(=O)/C=C/c1ccccc1)C
InChI Key	PFQIXBDZPIDCQY-CMDGGOBGSA-N
Molecular Formula	C13H16O5S
Exact Mass	284.328 g/mol

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Additional Information

Field	Value
Data last updated	January 29, 2025
Metadata last updated	January 29, 2025
Created	January 29, 2025
Format	HTML
License	No License Provided
Id	492ec829-7eee-4d1d-8834-02f1e3ed4039
Package id	10-14272-pfqixbdzpidcqy-cmdggobgsa-n-chmo0000470
Resource type	HTML
State	active