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((S)-3-Methyl-pent-4-enyl)-benzene
SpectraBase Compound ID Ag0AypwKAI0
InChI InChI=1S/C12H16/c1-3-11(2)9-10-12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3/t11-/m1/s1
InChIKey RECDVQPZVWBGII-LLVKDONJSA-N
Mol Weight 160.26 g/mol
Molecular Formula C12H16
Exact Mass 160.125201 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CoKZa3yVOga
Name ((S)-3-Methyl-pent-4-enyl)-benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 160.125200515 u
Formula C12H16
InChI InChI=1S/C12H16/c1-3-11(2)9-10-12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3/t11-/m1/s1
InChIKey RECDVQPZVWBGII-LLVKDONJSA-N
Molecular Weight 160.260 g/mol
SMILES C(=C)[C@](CCC1=CC=CC=C1)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962599