| SpectraBase Compound ID | 5WlPr93ZbbX |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-14-11(13)12-8-4-2-3-6-10(12)7-5-9-12/h6H,2-5,7-9H2,1H3 |
| InChIKey | UBNFIWXTRHHGMJ-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3xn7IAS5OE5 |
|---|---|
| Name | 2,3,4,5,6,7-Hexahydro-1H-azulene-3a-carboxylic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-14-11(13)12-8-4-2-3-6-10(12)7-5-9-12/h6H,2-5,7-9H2,1H3 |
| InChIKey | UBNFIWXTRHHGMJ-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C12(C(=O)OC)C(=CCCCC2)CCC1 |
| SPLASH | splash10-000i-0900000000-8a356c32ef22df8472d2 |
| Source of Spectrum | J-58-2208-14 |
| Wiley ID | 1191237 |