| SpectraBase Compound ID | 1pwR4c1MPVk |
|---|---|
| InChI | InChI=1S/C9H18O3/c1-4-8(10)7(3)6-12-9(11)5-2/h7-8,10H,4-6H2,1-3H3 |
| InChIKey | GRWIYERGGXHXIS-UHFFFAOYSA-N |
| Mol Weight | 174.24 g/mol |
| Molecular Formula | C9H18O3 |
| Exact Mass | 174.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9O2sp6Vhi82 |
|---|---|
| Name | 1,3-PENTANEDIOL, 2-METHYL-, 1-PROPANOATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H18O3 |
| InChI | InChI=1S/C9H18O3/c1-4-8(10)7(3)6-12-9(11)5-2/h7-8,10H,4-6H2,1-3H3 |
| InChIKey | GRWIYERGGXHXIS-UHFFFAOYSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 174.1251 |
| SMILES | OC(CC)C(C)COC(=O)CC |
| SPLASH | splash10-056r-9000000000-93af5b4aa5c524b71c7c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |