| SpectraBase Spectrum ID |
GWttxmcfH5F |
| Name |
2-Methylnaphthalene |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
91-57-6 |
| ChEBI ID |
50720 |
| Comments |
Saturated 2-methylnaphthalene - Sigma-Aldrich
Solvent CDCl3, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C11 H10 |
| IUPAC Name |
2-methylnaphthalene |
| InChI |
InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3 |
| InChIKey |
QIMMUPPBPVKWKM-UHFFFAOYSA-N |
| KEGG Compound ID |
C14098 |
| KEGG Pathways |
PATH: ko00624 1- and 2-Methylnaphthalene degradation
PATH: map07114 Naphthalene family |
| PubChem Compound ID |
7055 |
| SMILES |
CC1=CC2=CC=CC=C2C=C1 |
| Source File Reference |
bmse000537 |
