| SpectraBase Compound ID | KnLBzSsLXAw |
|---|---|
| InChI | InChI=1S/C7H8.C4H6O3.C4H10/c1-7-5-3-2-4-6-7;1-3-4(5)7-2-6-3;1-4(2)3/h2-6H,1H3;3H,2H2,1H3;4H,1-3H3 |
| InChIKey | MRPSMDPJBQHKEQ-UHFFFAOYSA-N |
| Mol Weight | 252.35 g/mol |
| Molecular Formula | C15H24O3 |
| Exact Mass | 252.172545 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G6N6iD9kx57 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C15H20O3 |
| InChI | InChI=1S/C7H8.C4H6O3.C4H10/c1-7-5-3-2-4-6-7;1-3-4(5)7-2-6-3;1-4(2)3/h2-6H,1H3;3H,2H2,1H3;4H,1-3H3 |
| InChIKey | MRPSMDPJBQHKEQ-UHFFFAOYSA-N |
| Molecular Weight | 252.1719 |
| SMILES | C(C)(C)C.C1(=O)C(OCO1)C.c1c(cccc1)C |
| SPLASH | splash10-000f-9600000000-f8780a48505e62153019 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |