| SpectraBase Compound ID | 1mADmTzg9RP |
|---|---|
| InChI | InChI=1S/C12H16O2/c1-3-4-5-10-6-8-11(9-7-10)12(13)14-2/h6-9H,3-5H2,1-2H3 |
| InChIKey | XJRYQLPELPLPHZ-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C12H16O2 |
| Exact Mass | 192.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4ymDNtAfN8P |
|---|---|
| Name | 4-N-butylbenzoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O2 |
| InChI | InChI=1S/C12H16O2/c1-3-4-5-10-6-8-11(9-7-10)12(13)14-2/h6-9H,3-5H2,1-2H3 |
| InChIKey | XJRYQLPELPLPHZ-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 192.258 g/mol |
| SMILES | CCCCc1ccc(cc1)C(=O)OC |
| SPLASH | splash10-0gvp-3900000000-fb3b0a0ef34746ca4dac |
| Source of Spectrum | SRH-2022-2204-0 |
| Wiley ID | 1824565 |