Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C7H13NO2S/c8-11(10,2-1-9)7-3-6(4-7)5-7/h6,8-9H,1-5H2
SMILES	OCCS(=O)(=N)C12CC(C1)C2
InChI Key	NMNCNBZSKZJASF-UHFFFAOYSA-N
Molecular Formula	C7H13NO2S
Exact Mass	175.249 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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• mass-spectrometry

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/NMNCNBZSKZJASF-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/NMNCNBZSKZJASF-UHFFFAOYSA-N/CHMO0000470
Version
Author	Lukas Langer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:20:27.650675
MetadataModified	2024-09-07T16:51:19.938312
MetadataPublished	2020-02-17

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
145926390	PubChem
The data in this table is sourced from UniChem at EBI.