Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C20H26O6P2/c1-23-27(21,24-2)19-13-18-12-10-16-7-5-15(6-8-16)9-11-17(19)14-20(18)28(22,25-3)26-4/h5-8,13-14H,9-12H2,1-4H3 |
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SMILES | COP(=O)(c1cc2CCc3ccc(CCc1cc2P(=O)(OC)OC)cc3)OC |
InChI Key | GMDSCBQOTFRVGY-UHFFFAOYSA-N |
Molecular Formula | C20H26O6P2 |
Exact Mass | 424.364 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/GMDSCBQOTFRVGY-UHFFFAOYSA-N/CHMO0000480 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/GMDSCBQOTFRVGY-UHFFFAOYSA-N/CHMO0000480 |
Version | |
Author | Christoph Zippel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T05:43:44.816804 |
MetadataModified | 2024-09-07T21:17:31.950175 |
MetadataPublished | 2022-01-20 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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162396632 | PubChem |
The data in this table is sourced from UniChem at EBI. |