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1-Ethyl-1,3,3-trimethyl-5-(1-methyl-3-propanal)indan

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

1-Ethyl-1,3,3-trimethyl-5-(1-methyl-3-propanal)indan
SpectraBase Compound ID 2GYyesSFRif
InChI InChI=1S/C18H26O/c1-6-18(5)12-17(3,4)16-11-14(7-8-15(16)18)13(2)9-10-19/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKey ODUMZLYKVWGWHS-UHFFFAOYSA-N
Mol Weight 258.4 g/mol
Molecular Formula C18H26O
Exact Mass 258.198365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 986pWU6IDt9
Name 1-Ethyl-1,3,3-trimethyl-5-(1-methyl-3-propanal)indan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.198365456 u
Formula C18H26O
InChI InChI=1S/C18H26O/c1-6-18(5)12-17(3,4)16-11-14(7-8-15(16)18)13(2)9-10-19/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKey ODUMZLYKVWGWHS-UHFFFAOYSA-N
Molecular Weight 258.405 g/mol
SMILES C1(=CC=C2C(=C1)C(C)(C)CC2(C)CC)C(CC=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920835