Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C9H17NO4/c1-7(11)3-5-9(10(13)14)6-4-8(2)12/h7,9,11H,3-6H2,1-2H3/t7-,9-/m0/s1
SMILES	C[C@@H](CC[C@H]([N+](=O)[O-])CCC(=O)C)O
InChI Key	RUKZNVUNYWBTLV-CBAPKCEASA-N
Molecular Formula	C9H17NO4
Exact Mass	203.236 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/RUKZNVUNYWBTLV-CBAPKCEASA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/RUKZNVUNYWBTLV-CBAPKCEASA-N/CHMO0000470
Version
Author	Gudrun Gygli
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:28:03.438894
MetadataModified	2024-09-07T19:40:26.229485
MetadataPublished	2021-05-07
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
155908639	PubChem
The data in this table is sourced from UniChem at EBI.