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(S)-3-(1"-Hydroxyethyl)-3-(phenylcarbamoyl)-1(3H)-isobenzofuranone
SpectraBase Compound ID DkG5R3fSl9D
InChI InChI=1S/C17H15NO4/c1-11(19)17(16(21)18-12-7-3-2-4-8-12)14-10-6-5-9-13(14)15(20)22-17/h2-11,19H,1H3,(H,18,21)/t11?,17-/m0/s1
InChIKey VYUZKNFTDDZMDZ-KLLZUTDZSA-N
Mol Weight 297.31 g/mol
Molecular Formula C17H15NO4
Exact Mass 297.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37KW6dp4mu
Name (S)-3-(1"-Hydroxyethyl)-3-(phenylcarbamoyl)-1(3H)-isobenzofuranone
Alternate Name(s) (1R)-1-[(1R)-1-hydroxyethyl]-3-oxo-N-phenyl-1,3-dihydro-2-benzofuran-1-carboxamide (3R,1''S)-3-(1''-Hydroxyethyl)-3-(phenylcarbamoyl)-1(3H)-benzofuranone (3RS,1''RS)-3-(1''-Hydroxyethyl)-3-(phenylcarbamoyl)-1(3H)-benzofuranone (R)-3-((S)-1''-Hydroxyethyl)-3-(phenylcarbamoyl)-1(3H)-isobenzofuranone
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Formula C17H15NO4
InChI InChI=1S/C17H15NO4/c1-11(19)17(16(21)18-12-7-3-2-4-8-12)14-10-6-5-9-13(14)15(20)22-17/h2-11,19H,1H3,(H,18,21)/t11?,17-/m0/s1
InChIKey VYUZKNFTDDZMDZ-KLLZUTDZSA-N
Molecular Weight 297.310 g/mol
SMILES N(C([C@@]1(C(O)C)OC(=O)c2c1cccc2)=O)c1ccccc1
SPLASH splash10-0lyo-3920000000-04f237dc8ad6e5981f60
Source of Spectrum F-51-6300-10
Wiley ID 792259