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(3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-pent-4-enyl-isoindolin-1-one
SpectraBase Compound ID JhHbRjCdDTW
InChI InChI=1S/C21H23NO3/c1-2-3-9-14-21(25)18-13-8-7-12-17(18)20(24)22(21)19(15-23)16-10-5-4-6-11-16/h2,4-8,10-13,19,23,25H,1,3,9,14-15H2/t19-,21-/m0/s1
InChIKey FWPNVHYZQIUBIZ-FPOVZHCZSA-N
Mol Weight 337.42 g/mol
Molecular Formula C21H23NO3
Exact Mass 337.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIO5w7u7gIW
Name (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-pent-4-enyl-isoindolin-1-one
Alternate Name(s) (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenylethyl]-3-pent-4-enyl-1-isoindolone (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenylethyl]-3-pent-4-enylisoindol-1-one (3S)-3-oxidanyl-2-[(1R)-2-oxidanyl-1-phenyl-ethyl]-3-pent-4-enyl-isoindol-1-one
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Formula C21H23NO3
InChI InChI=1S/C21H23NO3/c1-2-3-9-14-21(25)18-13-8-7-12-17(18)20(24)22(21)19(15-23)16-10-5-4-6-11-16/h2,4-8,10-13,19,23,25H,1,3,9,14-15H2/t19-,21-/m0/s1
InChIKey FWPNVHYZQIUBIZ-FPOVZHCZSA-N
Molecular Weight 337.419 g/mol
SMILES O[C@@]1(N([C@@](CO)(c2ccccc2)[H])C(c2ccccc12)=O)CCCC=C
SPLASH splash10-0a4i-1914000000-9e6ae88dff379ea96406
Source of Spectrum KC-60-1250-18
Wiley ID 1583247