SpectraBase Compound ID | EM26MEiqjqb |
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InChI | InChI=1S/C11H20O2/c1-4-6-7-9-11(8-5-2)13-10(3)12/h5,11H,2,4,6-9H2,1,3H3/t11-/m0/s1 |
InChIKey | HMHOTZHEOXSCGO-NSHDSACASA-N |
Mol Weight | 184.28 g/mol |
Molecular Formula | C11H20O2 |
Exact Mass | 184.14633 g/mol |
SpectraBase Spectrum ID | ByQloRcVdSW |
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Name | (4R)-o-Acetyl-1-nonen-4-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 184.146329882 u |
Formula | C11H20O2 |
InChI | InChI=1S/C11H20O2/c1-4-6-7-9-11(8-5-2)13-10(3)12/h5,11H,2,4,6-9H2,1,3H3/t11-/m0/s1 |
InChIKey | HMHOTZHEOXSCGO-NSHDSACASA-N |
Molecular Weight | 184.279 g/mol |
SMILES | C(=O)(O[C@@](CC=C)(CCCCC)[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966438 |