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(1R,5R,6R)-1-Nitro-2,6-diphenyl-3-oxa-bicyclo[3.1.0]hexane

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

(1R,5R,6R)-1-Nitro-2,6-diphenyl-3-oxa-bicyclo[3.1.0]hexane
SpectraBase Compound ID ALCbxTB63YC
InChI InChI=1S/C17H15NO3/c19-18(20)17-14(15(17)12-7-3-1-4-8-12)11-21-16(17)13-9-5-2-6-10-13/h1-10,14-16H,11H2/t14-,15+,16?,17+/m1/s1
InChIKey NHOZAVIYSCXYDY-GLDWBXLXSA-N
Mol Weight 281.31 g/mol
Molecular Formula C17H15NO3
Exact Mass 281.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1m3jDRRyxFq
Name (1R,5R,6R)-1-Nitro-2,6-diphenyl-3-oxa-bicyclo[3.1.0]hexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.105193344 u
Formula C17H15NO3
InChI InChI=1S/C17H15NO3/c19-18(20)17-14(15(17)12-7-3-1-4-8-12)11-21-16(17)13-9-5-2-6-10-13/h1-10,14-16H,11H2/t14-,15+,16?,17+/m1/s1
InChIKey NHOZAVIYSCXYDY-GLDWBXLXSA-N
SMILES [C@]12([C@@](COC2C2=CC=CC=C2)([H])[C@@]1(C=1C=CC=CC1)[H])N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849904