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10,18-Bisnorabieta-5,7,9(10),11,13-pentaene

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

10,18-Bisnorabieta-5,7,9(10),11,13-pentaene
SpectraBase Compound ID 483PBR2xQFk
InChI InChI=1S/C18H22/c1-12(2)14-7-10-17-15(11-14)8-9-16-13(3)5-4-6-18(16)17/h7-13H,4-6H2,1-3H3
InChIKey PEGDXOHRNDHEEB-UHFFFAOYSA-N
Mol Weight 238.37 g/mol
Molecular Formula C18H22
Exact Mass 238.172151 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FuJJotsZDjI
Name 10,18-Bisnorabieta-5,7,9(10),11,13-pentaene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.172150708 u
Formula C18H22
InChI InChI=1S/C18H22/c1-12(2)14-7-10-17-15(11-14)8-9-16-13(3)5-4-6-18(16)17/h7-13H,4-6H2,1-3H3
InChIKey PEGDXOHRNDHEEB-UHFFFAOYSA-N
Molecular Weight 238.374 g/mol
SMILES C1CC(C=2C(C1)=C1C(C=C(C=C1)C(C)C)=CC2)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932351