| SpectraBase Spectrum ID |
Ci94aDkkTWb |
| Name |
Coumarin |
| CAS Registry Number |
91-64-5 |
| Classification |
Flavor |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
146.036779431 u |
| Formula |
C9H6O2 |
| InChI |
InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H |
| InChIKey |
ZYGHJZDHTFUPRJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
146.145 g/mol |
| SMILES |
c1cc2c(OC(C=C2)=O)cc1 |
| SPLASH |
splash10-014j-6900000000-039b232dce2f8eea8d73 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: G |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_4365 |
