SpectraBase Compound ID | 5SzkBgkwc1e |
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InChI | InChI=1S/C10H18O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h9H,2-8H2,1H3/t9-/m1/s1 |
InChIKey | IFYYFLINQYPWGJ-SECBINFHSA-N |
Mol Weight | 170.25 g/mol |
Molecular Formula | C10H18O2 |
Exact Mass | 170.13068 g/mol |
SpectraBase Spectrum ID | JdHnDcN9I2y |
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Name | (+)-gamma-decalactone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 170.130679818 u |
Formula | C10H18O2 |
InChI | InChI=1S/C10H18O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h9H,2-8H2,1H3/t9-/m1/s1 |
InChIKey | IFYYFLINQYPWGJ-SECBINFHSA-N |
Molecular Weight | 170.252 g/mol |
SMILES | C1(O[C@](CCCCCC)(CC1)[H])=O |
Spectrum/Structure Validation Score (Raman) | 0.932509 |