Dataset

Gabapentin

This MassBank record with Accession MSBNK-UFZ-UF411401 contains the MS2 mass spectrum of Gabapentin with the InChIkey UGJMXCAKCUNAIE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)
SMILES NCC1(CC(O)=O)CCCCC1
InChI Key UGJMXCAKCUNAIE-UHFFFAOYSA-N
Molecular Formula C9H17NO2
Exact Mass 171.126 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF411401
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MetadataCreated 2024-01-11T21:53:46.488710
MetadataModified 2025-02-09T19:50:24.577358
MetadataPublished 2017-01-05
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