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2-exo-Bromo-3-endo-hydroxybicyclo[3.2.0]heptan-6-one
SpectraBase Compound ID DLcXD5wGfK9
InChI InChI=1S/C7H9BrO2/c8-7-4-2-5(9)3(4)1-6(7)10/h3-4,6-7,10H,1-2H2/t3-,4-,6+,7+/m1/s1 InChI=1S/C7H9BrO2/c8-7-4-2-5(9)3(4)1-6(7)10/h3-4,6-7,10H,1-2H2/t3-,4-,6+,7+/m0/s1
InChIKey PZDPQFNHGDOCGG-SOWDYBQPSA-N
Mol Weight 205.05 g/mol
Molecular Formula C7H9BrO2
Exact Mass 203.978593 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 7kvVFQ84o4M
Name 2-exo-Bromo-3-endo-hydroxybicyclo[3.2.0]heptan-6-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.978592528 u
Formula C7H9BrO2
InChI InChI=1S/C7H9BrO2/c8-7-4-2-5(9)3(4)1-6(7)10/h3-4,6-7,10H,1-2H2/t3-,4-,6+,7+/m1/s1
InChIKey PZDPQFNHGDOCGG-SOWDYBQPSA-N
SMILES O[C@]1(C[C@@]2([C@]([C@@]1(Br)[H])(CC2=O)[H])[H])[H]
Spectrum/Structure Validation Score (Raman) 0.85429