Dataset
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
Chemical Information
| InChI | InChI=1S/C9H7NO/c1-2-8-3-5-9(6-4-8)7-10-11/h1,3-7,11H/b10-7+ |
|---|---|
| SMILES | O/N=C/c1ccc(cc1)C#C |
| InChI Key | ZHXYVOBALGQTSJ-JXMROGBWSA-N |
| Exact Mass | 145.158 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/ZHXYVOBALGQTSJ-JXMROGBWSA-N/CHMO0002541 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/ZHXYVOBALGQTSJ-JXMROGBWSA-N/CHMO0002541 |
| Version | |
| Author | Robert Göstl |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2025-11-03 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | CHMO:0002541 |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |