| SpectraBase Compound ID | Cu0PXcECHhz |
|---|---|
| InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3 |
| InChIKey | ONWRVKPIVJMSHO-UHFFFAOYSA-N |
| Mol Weight | 178.23 g/mol |
| Molecular Formula | C11H14O2 |
| Exact Mass | 178.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C09290lRXAK |
|---|---|
| Name | BENZOIC ACID, 4-METHYL-, 1-METHYLETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H14O2 |
| InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3 |
| InChIKey | ONWRVKPIVJMSHO-UHFFFAOYSA-N |
| Molecular Weight | 178.0990 |
| SMILES | c1c(C(OC(C)C)=O)ccc(C)c1 |
| SPLASH | splash10-014l-8900000000-a9a54e2061faaffefb5c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |