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1-bromobicyclo[3.3.1]nonan-3-one
SpectraBase Compound ID BLJaRoYYNtN
InChI InChI=1S/C9H13BrO/c10-9-3-1-2-7(5-9)4-8(11)6-9/h7H,1-6H2
InChIKey QPXRGUYAQFPXGX-UHFFFAOYSA-N
Mol Weight 217.11 g/mol
Molecular Formula C9H13BrO
Exact Mass 216.014978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dsa7QpFXBTl
Name 5-Bromanylbicyclo[3.3.1]nonan-3-one
CAS Registry Number 66077-98-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13BrO
InChI InChI=1S/C9H13BrO/c10-9-3-1-2-7(5-9)4-8(11)6-9/h7H,1-6H2/t7-,9+/m0/s1
InChIKey QPXRGUYAQFPXGX-UHFFFAOYSA-N
Molecular Weight 217.106 g/mol
SMILES [C@@]12(CC(=O)C[C@@](C2)(CCC1)[H])Br
SPLASH splash10-000j-9500000000-167cc2f9190a2d1ea877
Source of Spectrum GT-1986-97-0
Synonyms 5-Bromo-3-bicyclo[3.3.1]nonanone 5-Bromobicyclo[3.3.1]nonan-3-one
Wiley ID 1215050