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2-[(1S)-1-phenylbutoxy]isoindole-1,3-dione
SpectraBase Compound ID Brv48hagP1P
InChI InChI=1S/C18H17NO3/c1-2-8-16(13-9-4-3-5-10-13)22-19-17(20)14-11-6-7-12-15(14)18(19)21/h3-7,9-12,16H,2,8H2,1H3/t16-/m0/s1
InChIKey OTZFBFICCRNUPI-INIZCTEOSA-N
Mol Weight 295.34 g/mol
Molecular Formula C18H17NO3
Exact Mass 295.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID x73Xsi7dJi
Name 2-[(1S)-1-phenylbutoxy]isoindole-1,3-dione
Alternate Name(s) 2-[(1S)-1-phenylbutoxy]isoindoline-1,3-dione 2-[(1S)-1-phenylbutoxy]isoindoline-1,3-quinone
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Formula C18H17NO3
InChI InChI=1S/C18H17NO3/c1-2-8-16(13-9-4-3-5-10-13)22-19-17(20)14-11-6-7-12-15(14)18(19)21/h3-7,9-12,16H,2,8H2,1H3/t16-/m0/s1
InChIKey OTZFBFICCRNUPI-INIZCTEOSA-N
Molecular Weight 295.338 g/mol
SMILES C1(N(C(c2ccccc12)=O)O[C@](c1ccccc1)(CCC)[H])=O
SPLASH splash10-000x-9500000000-147e960a7944591b8a6a
Source of Spectrum J-62-747-3
Wiley ID 1298350