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8-Methoxy-3,3-dimethyl-1,4-dihydronaphthalen-2-one
SpectraBase Compound ID 2zfg3K7ZUNw
InChI InChI=1S/C13H16O2/c1-13(2)8-9-5-4-6-11(15-3)10(9)7-12(13)14/h4-6H,7-8H2,1-3H3
InChIKey RAYCOYAJTUVTRA-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8mJ7U7tBzee
Name 8-Methoxy-3,3-dimethyl-1,4-dihydronaphthalen-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.115029753 u
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-13(2)8-9-5-4-6-11(15-3)10(9)7-12(13)14/h4-6H,7-8H2,1-3H3
InChIKey RAYCOYAJTUVTRA-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES C1(=O)CC=2C(=CC=CC2CC1(C)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.839253