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(3aR,4S,9aS)-N-phenyl-3,3a,4,9a-tetrahydro-2H-furo[2,3-b]chromen-4-amine

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

(3aR,4S,9aS)-N-phenyl-3,3a,4,9a-tetrahydro-2H-furo[2,3-b]chromen-4-amine
SpectraBase Compound ID HsIdj5qXDFL
InChI InChI=1S/C17H17NO2/c1-2-6-12(7-3-1)18-16-13-8-4-5-9-15(13)20-17-14(16)10-11-19-17/h1-9,14,16-18H,10-11H2/t14-,16-,17+/m1/s1
InChIKey QZYXOOXLRFQGSH-OIISXLGYSA-N
Mol Weight 267.33 g/mol
Molecular Formula C17H17NO2
Exact Mass 267.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GA6jVOc65sm
Name (3ar,4S,9as)-N-Phenyl-3,3A,4,9A-tetrahydro-2H-furo[2,3-B]chromen-4-amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.125928789 u
Formula C17H17NO2
InChI InChI=1S/C17H17NO2/c1-2-6-12(7-3-1)18-16-13-8-4-5-9-15(13)20-17-14(16)10-11-19-17/h1-9,14,16-18H,10-11H2/t14-,16-,17+/m1/s1
InChIKey QZYXOOXLRFQGSH-OIISXLGYSA-N
SMILES C1=CC2=C(C=C1)O[C@]1([C@]([C@@]2(NC2=CC=CC=C2)[H])([H])CCO1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.856316