Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C14H19NO2/c1-11(2)15-7-6-12-4-5-13(10-14(12)15)17-9-8-16-3/h4-7,10-11H,8-9H2,1-3H3
SMILES COCCOc1ccc2c(c1)n(cc2)C(C)C
InChI Key ZVJFHSSZXWFKTI-UHFFFAOYSA-N
Molecular Formula C14H19NO2
Exact Mass 233.306 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZVJFHSSZXWFKTI-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/ZVJFHSSZXWFKTI-UHFFFAOYSA-N/CHMO0000470
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:12:37.953132
MetadataModified 2024-09-08T01:12:37.953138
MetadataPublished 2023-07-31
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