SpectraBase Compound ID | K0Ns0MeePlF |
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InChI | InChI=1S/C9H16O4/c1-6(11)3-4-9(12,5-10)8-7(2)13-8/h3-4,6-8,10-12H,5H2,1-2H3/b4-3+/t6-,7+,8+,9+/m0/s1 |
InChIKey | ZXCYAEKEHIEQHD-YKWSYBCASA-N |
Mol Weight | 188.22 g/mol |
Molecular Formula | C9H16O4 |
Exact Mass | 188.104859 g/mol |
SpectraBase Spectrum ID | BS3RZi5P1ps |
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Name | Aspinonene |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H16O4 |
InChI | InChI=1S/C9H16O4/c1-6(11)3-4-9(12,5-10)8-7(2)13-8/h3-4,6-8,10-12H,5H2,1-2H3/b4-3+/t6-,7+,8+,9+/m0/s1 |
InChIKey | ZXCYAEKEHIEQHD-YKWSYBCASA-N |
Molecular Weight | 188.223 g/mol |
SMILES | O[C@](\C=C\[C@@](CO)([C@@]1(O[C@@]1(C)[H])[H])O)(C)[H] |
SPLASH | splash10-0007-9000000000-68ee5c7778bfe5c05831 |
Source of Spectrum | U-1994-833-1 |
Wiley ID | 766049 |