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3-(2-Bromopropionyl)-(4R,5S)-indano[1,2-d]oxazolidin-2-one isomer
SpectraBase Compound ID BPXrgA0w2T4
InChI InChI=1S/C13H12BrNO3/c1-7(14)12(16)15-11-9-5-3-2-4-8(9)6-10(11)18-13(15)17/h2-5,7,10-11H,6H2,1H3/t7?,10-,11+/m0/s1
InChIKey YEIMKSYZTUUPHV-ZJVIIBSASA-N
Mol Weight 310.15 g/mol
Molecular Formula C13H12BrNO3
Exact Mass 309.000056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66mP2wqB5lu
Name 3-(2-Bromopropionyl)-(4R,5S)-indano[1,2-d]oxazolidin-2-one isomer
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Formula C13H12BrNO3
InChI InChI=1S/C13H12BrNO3/c1-7(14)12(16)15-11-9-5-3-2-4-8(9)6-10(11)18-13(15)17/h2-5,7,10-11H,6H2,1H3/t7?,10-,11+/m0/s1
InChIKey YEIMKSYZTUUPHV-ZJVIIBSASA-N
Molecular Weight 310.147 g/mol
SMILES C1(N([C@]2([C@@](O1)(Cc1c2cccc1)[H])[H])C(=O)C(Br)C)=O
SPLASH splash10-0159-0953000000-bf09f6f7b359926e8452
Source of Spectrum F-69-493-1
Wiley ID 1594518