Dataset

Sinapaldehyde

This MassBank record with Accession MSBNK-RIKEN-PR309000 contains the MS2 mass spectrum of Sinapaldehyde with the InChIkey CDICDSOGTRCHMG-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3
SMILES O=CC=CC=1C=C(OC)C(O)=C(OC)C=1
InChI Key CDICDSOGTRCHMG-UHFFFAOYSA-N
Molecular Formula C11H12O4
Exact Mass 208.213 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309000
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MetadataCreated 2024-01-11T19:50:46.485034
MetadataModified 2025-02-09T18:39:59.012214
MetadataPublished 2019-03-28
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