Dataset
electrospray ionisation quadrupole detection (ESI Q Trap)
Chemical Information
| InChI | InChI=1S/C16H20O2/c1-15(2,3)18-14(17)16(4)12-9-10-7-5-6-8-11(10)13(12)16/h5-8,12-13H,9H2,1-4H3 |
|---|---|
| SMILES | O=C(C1(C)C2C1c1c(C2)cccc1)OC(C)(C)C |
| InChI Key | FLJWBOCPBSZGNR-UHFFFAOYSA-N |
| Molecular Formula | C16H20O2 |
| Exact Mass | 244.329 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/FLJWBOCPBSZGNR-UHFFFAOYSA-N/CHMO0002337 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/FLJWBOCPBSZGNR-UHFFFAOYSA-N/CHMO0002337 |
| Version | |
| Author | Christoph Zippel |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2025-05-22 |
| Related Molecule |
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| Field | Value |
|---|---|
| Measurement Technique | electrospray ionisation quadrupole detection |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |