| SpectraBase Spectrum ID |
5Y2NCf9AJGq |
| Name |
1,4-Naphthoquinone |
| CAS Registry Number |
130-15-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
158.036779431 u |
| Formula |
C10H6O2 |
| InChI |
InChI=1S/C10H6O2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H |
| InChIKey |
FRASJONUBLZVQX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
158.156 g/mol |
| Nominal Mass |
158 u |
| Quality |
960 |
| Retention Index |
1201 |
| SMILES |
C=12C(C(C=CC2=O)=O)=CC=CC1 |
| SPLASH |
splash10-0zfr-4900000000-8ca15e3e40ae141d71ce |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Naphthalene-1,4-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006909 |
