SpectraBase Compound ID | HIF2aDY8cnv |
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InChI | InChI=1S/C7H14.C3H6/c1-7-5-3-2-4-6-7;1-3-2/h7H,2-6H2,1H3;3H,1H2,2H3 |
InChIKey | XNBRHKRFLDPZAB-UHFFFAOYSA-N |
Mol Weight | 140.27 g/mol |
Molecular Formula | C10H20 |
Exact Mass | 140.156501 g/mol |
SpectraBase Spectrum ID | EqEUfpNJFfq |
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Name | (+)-trans-limonenoxide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.156500644 u |
Formula | C10H20 |
InChI | InChI=1S/C7H14.C3H6/c1-7-5-3-2-4-6-7;1-3-2/h7H,2-6H2,1H3;3H,1H2,2H3 |
InChIKey | XNBRHKRFLDPZAB-UHFFFAOYSA-N |
Molecular Weight | 140.270 g/mol |
Nominal Mass | 140 u |
SMILES | C(C)=C.C1CC(C)CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954226 |