Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C25H22O/c26-25-23-4-2-1-3-19(23)15-16-22-20-11-9-17-5-7-18(8-6-17)10-12-21(14-13-20)24(22)25/h1-8,13-14H,9-12,15-16H2 |
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SMILES | O=C1c2c3CCc4ccc(CCc(c2CCc2c1cccc2)cc3)cc4 |
InChI Key | IDTBYMIQPLRBEI-UHFFFAOYSA-N |
Molecular Formula | C25H22O |
Exact Mass | 338.442 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/IDTBYMIQPLRBEI-UHFFFAOYSA-N/IR |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/IDTBYMIQPLRBEI-UHFFFAOYSA-N/IR |
Version | |
Author | Yu-Chieh Huang |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:14:35.710508 |
MetadataModified | 2024-09-07T15:19:07.947873 |
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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138453490 | PubChem |
The data in this table is sourced from UniChem at EBI. |