Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C11H9N5O2/c17-10-6-16(15-14-10)5-9-11(18)13-8-4-2-1-3-7(8)12-9/h1-4,6,17H,5H2,(H,13,18) |
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SMILES | Oc1nnn(c1)Cc1nc2ccccc2[nH]c1=O |
InChI Key | ZRWWUXPKUJWJNV-UHFFFAOYSA-N |
Molecular Formula | C11H9N5O2 |
Exact Mass | 243.221 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/ZRWWUXPKUJWJNV-UHFFFAOYSA-N/IR |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ZRWWUXPKUJWJNV-UHFFFAOYSA-N/IR |
Version | |
Author | Yu-Chieh Huang |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:34:10.727809 |
MetadataModified | 2024-09-07T15:48:11.216392 |
MetadataPublished | 2019-06-27 |
Related Molecule |
Field | Value |
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Measurement Technique | infrared absorption spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |