Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C12H11N5/c1-9-7-12(15-13-9)17-8-11(14-16-17)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,15) |
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SMILES | Cc1[nH]nc(c1)n1nnc(c1)c1ccccc1 |
InChI Key | BTYPCTNIHDBBSH-UHFFFAOYSA-N |
Molecular Formula | C12H11N5 |
Exact Mass | 225.249 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/BTYPCTNIHDBBSH-UHFFFAOYSA-N/CHMO0000630 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/BTYPCTNIHDBBSH-UHFFFAOYSA-N/CHMO0000630 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:35:04.801039 |
MetadataModified | 2024-09-08T02:35:04.801045 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | infrared absorption spectroscopy |
Measurement Variables |