SpectraBase Compound ID | F8KdU0iAQI6 |
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InChI | InChI=1S/C15H26O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h11-14,16H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15-/m0/s1 |
InChIKey | XEUOFHGEEFUFIJ-JARUQAPTSA-N |
Mol Weight | 222.37 g/mol |
Molecular Formula | C15H26O |
Exact Mass | 222.198365 g/mol |
SpectraBase Spectrum ID | IpzmwV1bA8Z |
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Name | Dihydro-.alpha.-cyperol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 222.198365456 u |
Formula | C15H26O |
InChI | InChI=1S/C15H26O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h11-14,16H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15-/m0/s1 |
InChIKey | XEUOFHGEEFUFIJ-JARUQAPTSA-N |
Molecular Weight | 222.372 g/mol |
SMILES | [C@@]12([C@@](CC[C@](C2)(C(=C)C)[H])(CC[C@]([C@]1(C)[H])(O)[H])C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920552 |