Dataset

electron ionisation mass spectrometry (EI-MS)

Chemical Info

InChI	InChI=1S/C9H14O2S2/c1-2-11-8(10)4-5-9-12-6-3-7-13-9/h4-5,9H,2-3,6-7H2,1H3/b5-4+
SMILES	CCOC(=O)/C=C/C1SCCCS1
InChI Key	IXVZJURLEZZPFH-SNAWJCMRSA-N
Molecular Formula	C9H14O2S2
Exact Mass	218.336 g/mol

Data and Resources

• electron ionisation mass spectrometry (EI-MS)HTML
  Explore

  • More information
  • Go to resource

• electron-ionisation...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/IXVZJURLEZZPFH-SNAWJCMRSA-N/Mass/EI
License URL
Source	https://www.chemotion-repository.net/inchikey/IXVZJURLEZZPFH-SNAWJCMRSA-N/Mass/EI
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:47:33.637174
MetadataModified	2024-09-07T12:21:16.480448
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	electron ionisation mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL20548990	SureChEMBL
73427313	PubChem
The data in this table is sourced from UniChem at EBI.