| SpectraBase Spectrum ID |
JIP2nXkBvYu |
| Name |
Methyl 1-naphthoate |
| CAS Registry Number |
2459-24-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
186.068079560 u |
| Formula |
C12H10O2 |
| InChI |
InChI=1S/C12H10O2/c1-14-12(13)11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3 |
| InChIKey |
HMRROBKAACRWBP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
186.210 g/mol |
| Nominal Mass |
186 u |
| Quality |
987 |
| Retention Index |
1659 |
| SMILES |
C=12C(C(OC)=O)=CC=CC2=CC=CC1 |
| SPLASH |
splash10-056r-1900000000-302ca138ce0b441121a6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl naphthoate
1-Naphthalenecarboxylic acid methyl ester
1-Naphthoic acid methyl ester
Methyl-naphthalene-1-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015903 |
