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2,2,5,7,8-Pentamethyl-6-hydroxychroman, N-pentyl ether

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2,2,5,7,8-Pentamethyl-6-hydroxychroman, N-pentyl ether
SpectraBase Compound ID 8G7tond7CVG
InChI InChI=1S/C19H30O2/c1-7-8-9-12-20-17-13(2)14(3)18-16(15(17)4)10-11-19(5,6)21-18/h7-12H2,1-6H3
InChIKey LRRCULPLOLDDAB-UHFFFAOYSA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CP9fBOd4BeH
Name 2,2,5,7,8-Pentamethyl-6-hydroxychroman, N-pentyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.224580204 u
Formula C19H30O2
InChI InChI=1S/C19H30O2/c1-7-8-9-12-20-17-13(2)14(3)18-16(15(17)4)10-11-19(5,6)21-18/h7-12H2,1-6H3
InChIKey LRRCULPLOLDDAB-UHFFFAOYSA-N
SMILES C12=C(C(=C(C(=C2OC(CC1)(C)C)C)C)OCCCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849096