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2-(3-Methoxy-4-phenylmethoxy-phenyl)-2-(4-phenylmethoxyphenyl)ethanamine
SpectraBase Compound ID ADRgwfZ042m
InChI InChI=1S/C29H29NO3/c1-31-29-18-25(14-17-28(29)33-21-23-10-6-3-7-11-23)27(19-30)24-12-15-26(16-13-24)32-20-22-8-4-2-5-9-22/h2-18,27H,19-21,30H2,1H3
InChIKey QFTDOMBOLBJPQQ-UHFFFAOYSA-N
Mol Weight 439.56 g/mol
Molecular Formula C29H29NO3
Exact Mass 439.214744 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CMI09NIfHxG
Name 2-(3-Methoxy-4-phenylmethoxy-phenyl)-2-(4-phenylmethoxyphenyl)ethanamine
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 439.214743795 u
Formula C29H29NO3
InChI InChI=1S/C29H29NO3/c1-31-29-18-25(14-17-28(29)33-21-23-10-6-3-7-11-23)27(19-30)24-12-15-26(16-13-24)32-20-22-8-4-2-5-9-22/h2-18,27H,19-21,30H2,1H3
InChIKey QFTDOMBOLBJPQQ-UHFFFAOYSA-N
Molecular Weight 439.555 g/mol
SMILES C(C(C=1C=CC(=CC1)OCC=1C=CC=CC1)C=1C=C(C(=CC1)OCC=1C=CC=CC1)OC)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.89072