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1-[(2Z)-5-Butylhexa-2,5-dien-1-yl]-4-methoxybenzene
SpectraBase Compound ID GtGCXAkBnwK
InChI InChI=1S/C17H24O/c1-4-5-8-15(2)9-6-7-10-16-11-13-17(18-3)14-12-16/h6-7,11-14H,2,4-5,8-10H2,1,3H3/b7-6-
InChIKey HPHBSDLOEGKYAB-SREVYHEPSA-N
Mol Weight 244.38 g/mol
Molecular Formula C17H24O
Exact Mass 244.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FEVt7pHitlx
Name 1-[(2Z)-5-Butylhexa-2,5-dien-1-yl]-4-methoxybenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.182715392 u
Formula C17H24O
InChI InChI=1S/C17H24O/c1-4-5-8-15(2)9-6-7-10-16-11-13-17(18-3)14-12-16/h6-7,11-14H,2,4-5,8-10H2,1,3H3/b7-6-
InChIKey HPHBSDLOEGKYAB-SREVYHEPSA-N
Molecular Weight 244.378 g/mol
SMILES C=1C=C(C\C=C/CC(CCCC)=C)C=CC1OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938414