SpectraBase Compound ID | 4KbGvfEfMsL |
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InChI | InChI=1S/C11H20/c1-5-9-7-8-10(6-2)11(9,3)4/h7,10H,5-6,8H2,1-4H3/t10-/m0/s1 |
InChIKey | LWXQOZZNRURMTB-JTQLQIEISA-N |
Mol Weight | 152.28 g/mol |
Molecular Formula | C11H20 |
Exact Mass | 152.156501 g/mol |
SpectraBase Spectrum ID | 7CkG7MXPIaS |
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Name | (S)-2,4-Diethyl-3,3-dimethycyclolopentene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 152.156500644 u |
Formula | C11H20 |
InChI | InChI=1S/C11H20/c1-5-9-7-8-10(6-2)11(9,3)4/h7,10H,5-6,8H2,1-4H3/t10-/m0/s1 |
InChIKey | LWXQOZZNRURMTB-JTQLQIEISA-N |
Molecular Weight | 152.281 g/mol |
SMILES | C1(C(=CC[C@@]1(CC)[H])CC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966498 |