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(2-Nitrocyclohex-2-enyl)benzene

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

(2-Nitrocyclohex-2-enyl)benzene
SpectraBase Compound ID IRr4LqmaxnK
InChI InChI=1S/C12H13NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,9,11H,4-5,8H2
InChIKey SZUIOINEHXCGBZ-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6mPyl9rP3Vb
Name (2-Nitrocyclohex-2-enyl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.094628661 u
Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,9,11H,4-5,8H2
InChIKey SZUIOINEHXCGBZ-UHFFFAOYSA-N
Molecular Weight 203.241 g/mol
SMILES C1CC(C2=CC=CC=C2)C(=CC1)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833184