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(R)-(+)-2-[2-(4-Bromophenyl)ethyl]-1,3-propanediol Monoacetate
SpectraBase Compound ID 1MkVyWKWiF3
InChI InChI=1S/C13H17BrO3/c1-10(16)17-9-12(8-15)3-2-11-4-6-13(14)7-5-11/h4-7,12,15H,2-3,8-9H2,1H3/t12-/m1/s1
InChIKey NSNFYIMQCMXZTN-GFCCVEGCSA-N
Mol Weight 301.18 g/mol
Molecular Formula C13H17BrO3
Exact Mass 300.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkAx7wBSxqA
Name (R)-(+)-2-[2-(4-Bromophenyl)ethyl]-1,3-propanediol Monoacetate
Alternate Name(s) (2R)-4-(4-bromophenyl)-2-(hydroxymethyl)butyl acetate Acetic acid [(2R)-4-(4-bromophenyl)-2-(hydroxymethyl)butyl] ester [(2R)-4-(4-bromophenyl)-2-(hydroxymethyl)butyl] acetate [(2R)-4-(4-bromophenyl)-2-(hydroxymethyl)butyl] ethanoate
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Formula C13H17BrO3
InChI InChI=1S/C13H17BrO3/c1-10(16)17-9-12(8-15)3-2-11-4-6-13(14)7-5-11/h4-7,12,15H,2-3,8-9H2,1H3/t12-/m1/s1
InChIKey NSNFYIMQCMXZTN-GFCCVEGCSA-N
Molecular Weight 301.180 g/mol
SMILES OC[C@](COC(=O)C)(CCc1ccc(cc1)Br)[H]
SPLASH splash10-001l-6900000000-d1f8a7bd259d7d94f5d8
Source of Spectrum J-59-7042-6
Wiley ID 1302457