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KWHUHTFXMNQHAA-UHFFFAOYSA-N

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, 3 MS (GC), and 2 Near IR

KWHUHTFXMNQHAA-UHFFFAOYSA-N
SpectraBase Compound ID EiWp4RXPWje
InChI InChI=1S/C11H12O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7H,2,4,6,8H2
InChIKey KWHUHTFXMNQHAA-UHFFFAOYSA-N
Mol Weight 160.22 g/mol
Molecular Formula C11H12O
Exact Mass 160.088815 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74e6xjf3V8x
Name 1-Benzosuberone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number B10587
CAS Registry Number 826-73-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O
InChI InChI=1S/C11H12O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7H,2,4,6,8H2
InChIKey KWHUHTFXMNQHAA-UHFFFAOYSA-N
Observed nucleus 1H
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 6,7,8,9-Tetrahydro-5-benzocycloheptenone
Wiley ID SIAL_1HNMR_010730