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1-(3-Isopropyl-4-methyl-pent-3-en-1-ynyl)-1-methyl-cyclopropane

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

1-(3-Isopropyl-4-methyl-pent-3-en-1-ynyl)-1-methyl-cyclopropane
SpectraBase Compound ID I1mUtNZkyqU
InChI InChI=1S/C13H20/c1-10(2)12(11(3)4)6-7-13(5)8-9-13/h10H,8-9H2,1-5H3
InChIKey IZYUYJOUHDJGGP-UHFFFAOYSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5CEZTwgtC4Q
Name 1-(3-Isopropyl-4-methyl-pent-3-en-1-ynyl)-1-methyl-cyclopropane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.156500644 u
Formula C13H20
InChI InChI=1S/C13H20/c1-10(2)12(11(3)4)6-7-13(5)8-9-13/h10H,8-9H2,1-5H3
InChIKey IZYUYJOUHDJGGP-UHFFFAOYSA-N
Molecular Weight 176.303 g/mol
SMILES C1CC1(C)C#CC(=C(C)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.858168