| SpectraBase Compound ID | ERFZ5LkZXLq |
|---|---|
| InChI | InChI=1S/C13H18O/c1-11-5-7-12(8-6-11)13(2,3)9-4-10-14/h5-8,10H,4,9H2,1-3H3 |
| InChIKey | LHQUALTUGAZBDG-UHFFFAOYSA-N |
| Mol Weight | 190.29 g/mol |
| Molecular Formula | C13H18O |
| Exact Mass | 190.135765 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AqVMB9D934u |
|---|---|
| Name | Benzenebutanal, gamma,gamma,4-trimethyl- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H18O |
| InChI | InChI=1S/C13H18O/c1-11-5-7-12(8-6-11)13(2,3)9-4-10-14/h5-8,10H,4,9H2,1-3H3 |
| InChIKey | LHQUALTUGAZBDG-UHFFFAOYSA-N |
| Molecular Weight | 190.1353 |
| SMILES | Cc1ccc(C(CCC=O)(C)C)cc1 |
| SPLASH | splash10-001i-3900000000-852b7fd568eb2c8aee3b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |