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1H-1,2,4-Triazole-1-ethanol, alpha-[5-methyl-2-(1-methylethyl)-1,3-dioxan-5-yl]-beta-(3-phenoxypropyl)-

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1H-1,2,4-Triazole-1-ethanol, alpha-[5-methyl-2-(1-methylethyl)-1,3-dioxan-5-yl]-beta-(3-phenoxypropyl)-
SpectraBase Compound ID 9G7rXRJ2IQr
InChI InChI=1S/C21H31N3O4/c1-16(2)20-27-12-21(3,13-28-20)19(25)18(24-15-22-14-23-24)10-7-11-26-17-8-5-4-6-9-17/h4-6,8-9,14-16,18-20,25H,7,10-13H2,1-3H3
InChIKey YLQPNRPPRVJIHZ-UHFFFAOYSA-N
Mol Weight 389.5 g/mol
Molecular Formula C21H31N3O4
Exact Mass 389.231456 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HQM75L2stDb
Name 1H-1,2,4-Triazole-1-ethanol, alpha-[5-methyl-2-(1-methylethyl)-1,3-dioxan-5-yl]-beta-(3-phenoxypropyl)-
CAS Registry Number 106574-30-5
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H31N3O4
InChI InChI=1S/C21H31N3O4/c1-16(2)20-27-12-21(3,13-28-20)19(25)18(24-15-22-14-23-24)10-7-11-26-17-8-5-4-6-9-17/h4-6,8-9,14-16,18-20,25H,7,10-13H2,1-3H3
InChIKey YLQPNRPPRVJIHZ-UHFFFAOYSA-N
Instrument Name Bruker IFS 112
Technique KBr-Pellet