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5-Methyl-7-bicyclo[3.2.0]heptanone
SpectraBase Compound ID C63x3Eh63mu
InChI InChI=1S/C8H12O/c1-8-4-2-3-6(8)7(9)5-8/h6H,2-5H2,1H3
InChIKey DOJSZSVGTBFKNV-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol
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Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9pK9Yzv3f40
Name 5-Methyl-7-bicyclo[3.2.0]heptanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 124.088815005 u
Formula C8H12O
InChI InChI=1S/C8H12O/c1-8-4-2-3-6(8)7(9)5-8/h6H,2-5H2,1H3
InChIKey DOJSZSVGTBFKNV-UHFFFAOYSA-N
Molecular Weight 124.183 g/mol
SMILES C12(C(CCC2)C(C1)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.919499
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