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(3R)-3-(bromomethyl)hexanoic acid
SpectraBase Compound ID 3FbcX4IZPXY
InChI InChI=1S/C7H13BrO2/c1-2-3-6(5-8)4-7(9)10/h6H,2-5H2,1H3,(H,9,10)/t6-/m1/s1
InChIKey XUBVYXDJGCTGTL-ZCFIWIBFSA-N
Mol Weight 209.08 g/mol
Molecular Formula C7H13BrO2
Exact Mass 208.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXhCO2Gxiqt
Name (3R)-3-(bromomethyl)hexanoic acid
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13BrO2
InChI InChI=1S/C7H13BrO2/c1-2-3-6(5-8)4-7(9)10/h6H,2-5H2,1H3,(H,9,10)/t6-/m1/s1
InChIKey XUBVYXDJGCTGTL-ZCFIWIBFSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 209.083 g/mol
SMILES OC(C[C@](CBr)(CCC)[H])=O
SPLASH splash10-00di-9300000000-f2e4e18e4d3b6d0a2eb3
Source of Spectrum WO2020148787A1
Wiley ID 1879817