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((1R,2S)-2-Propa-1,2-dienyl-cyclopentyl)-benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

((1R,2S)-2-Propa-1,2-dienyl-cyclopentyl)-benzene
SpectraBase Compound ID 6zCcpBuOnS
InChI InChI=1S/C14H16/c1-2-7-12-10-6-11-14(12)13-8-4-3-5-9-13/h3-5,7-9,12,14H,1,6,10-11H2/t12-,14-/m1/s1
InChIKey MNHPPFMAYPDSSV-TZMCWYRMSA-N
Mol Weight 184.28 g/mol
Molecular Formula C14H16
Exact Mass 184.125201 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ct59QD0FXfd
Name ((1R,2S)-2-Propa-1,2-dienyl-cyclopentyl)-benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 184.125200515 u
Formula C14H16
InChI InChI=1S/C14H16/c1-2-7-12-10-6-11-14(12)13-8-4-3-5-9-13/h3-5,7-9,12,14H,1,6,10-11H2/t12-,14-/m1/s1
InChIKey MNHPPFMAYPDSSV-TZMCWYRMSA-N
Molecular Weight 184.282 g/mol
SMILES C(=C=C)[C@]1([C@](C=2C=CC=CC2)(CCC1)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907369