Dataset
mass spectrometry (MS)
Chemical Info
InChI | InChI=1S/C20H13ClN2O4/c21-15-6-8-16(9-7-15)22-23-18-11-14(20(26)27)5-10-17(18)12-1-3-13(4-2-12)19(24)25/h1-11H,(H,24,25)(H,26,27)/b23-22+ |
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SMILES | Clc1ccc(cc1)/N=N/c1cc(ccc1c1ccc(cc1)C(=O)O)C(=O)O |
InChI Key | IRLRFFNCEJWNJF-GHVJWSGMSA-N |
Molecular Formula | C20H13ClN2O4 |
Exact Mass | 380.781 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/IRLRFFNCEJWNJF-GHVJWSGMSA-N/Mass |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/IRLRFFNCEJWNJF-GHVJWSGMSA-N/Mass |
Version | |
Author | Sylvain Grosjean |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:04:52.493187 |
MetadataModified | 2024-09-07T15:04:54.432104 |
MetadataPublished | 2019-04-25 |
Field | Value |
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Measurement Technique | mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |