Gabapentin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU167802
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU167802 contains the MS2 mass spectrum of Gabapentin with the InChIkey UGJMXCAKCUNAIE-UHFFFAOYSA-N.
Source: Gabapentin
Chemical Info
| 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 |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 8f070443-29ee-478f-8cfe-a8061a0c5b8a |
| Package id | msbnk-athens_univ-au167802 |
| Resource type | HTML |
| State | active |