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1H,9H-Furo[3,4-d]isoindole-1,9-dione, 3,3a,6,6a,7,8-hexahydro-5,6-dimethyl-7-(phenylmethyl)-, (3a.alpha.,6.beta.,6a.beta.,7.alpha.,9aS*)-
SpectraBase Compound ID K7kCeQIMJUl
InChI InChI=1S/C19H21NO3/c1-11-8-14-10-23-18(22)19(14)16(12(11)2)15(20-17(19)21)9-13-6-4-3-5-7-13/h3-8,12,14-16H,9-10H2,1-2H3,(H,20,21)/t12-,14-,15+,16-,19-/m1/s1
InChIKey XMHWVMFUTVHSBR-IIRRGFMQSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1f2vPEQHy72
Name 1H,9H-Furo[3,4-d]isoindole-1,9-dione, 3,3a,6,6a,7,8-hexahydro-5,6-dimethyl-7-(phenylmethyl)-, (3a.alpha.,6.beta.,6a.beta.,7.alpha.,9aS*)-
Alternate Name(s) (3aS,6S,6aS,7S,9aS)-7-benzyl-5,6-dimethyl-6,6a,7,8-tetrahydro-3H-furo[3,4-d]isoindole-1,9(3aH)-dione 3.alpha.,4.alpha.-(furan-2'-one-4',3'-diyl)-4.beta.,5.beta.-(5''b-phenyl-2''-ooxopyrrole-3'',4''-diyl)-1,6.alpha.-dimethylcyclohex-1-ene 3.alpha.,4.alpha.-(furan-2'-one-4',3'-diyl)-4.beta.,5.beta.-(5''b-phenyl-2''-ooxopyrrole-3'',4''-diyl)-1,6.alpha.-dimethylcyclohex-1-ene
CAS Registry Number 69854-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-11-8-14-10-23-18(22)19(14)16(12(11)2)15(20-17(19)21)9-13-6-4-3-5-7-13/h3-8,12,14-16H,9-10H2,1-2H3,(H,20,21)/t12-,14-,15+,16-,19-/m1/s1
InChIKey XMHWVMFUTVHSBR-IIRRGFMQSA-N
Molecular Weight 311.381 g/mol
SMILES N1[C@]([C@@]2([C@@]3(C1=O)[C@](C=C([C@]2(C)[H])C)(COC3=O)[H])[H])(Cc1ccccc1)[H]
SPLASH splash10-00gi-0950000000-90f236f2914f88a72e72
Source of Spectrum KC-1978-1506-0
Wiley ID 1312565