Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C34H29N/c1-3-7-31(8-4-1)35(32-9-5-2-6-10-32)33-23-21-30(22-24-33)34-25-28-16-15-26-11-13-27(14-12-26)17-19-29(34)20-18-28/h1-14,18,20-25H,15-17,19H2 |
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SMILES | c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)c1cc2ccc1CCc1ccc(CC2)cc1 |
InChI Key | ROUMDNPPUPSBDL-UHFFFAOYSA-N |
Molecular Formula | C34H29N |
Exact Mass | 451.601 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ROUMDNPPUPSBDL-UHFFFAOYSA-N/IR |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ROUMDNPPUPSBDL-UHFFFAOYSA-N/IR |
Version | |
Author | Stefan Bräse |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:32:35.185991 |
MetadataModified | 2024-09-07T15:45:52.658117 |
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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J2.314.116G | Nikkaji |
102183805 | PubChem |
The data in this table is sourced from UniChem at EBI. |