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(4aR,11aS)-2,3,4,4a,5,11a-hexahydro-1H-benzo[c][1]benzazepine-6,11-dione
SpectraBase Compound ID HDBnx3zlqBK
InChI InChI=1S/C14H15NO2/c16-13-9-5-1-2-6-10(9)14(17)15-12-8-4-3-7-11(12)13/h1-2,5-6,11-12H,3-4,7-8H2,(H,15,17)/t11-,12+/m0/s1
InChIKey FPEFCJFEGFXITI-NWDGAFQWSA-N
Mol Weight 229.28 g/mol
Molecular Formula C14H15NO2
Exact Mass 229.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Am5wr8mLp0N
Name (4aR,11aS)-2,3,4,4a,5,11a-hexahydro-1H-benzo[c][1]benzazepine-6,11-dione
Alternate Name(s) (4aR,11aS)-2,3,4,4a,5,11a-hexahydro-1H-benzo[c][1]benzazepine-6,11-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO2
InChI InChI=1S/C14H15NO2/c16-13-9-5-1-2-6-10(9)14(17)15-12-8-4-3-7-11(12)13/h1-2,5-6,11-12H,3-4,7-8H2,(H,15,17)/t11-,12+/m0/s1
InChIKey FPEFCJFEGFXITI-NWDGAFQWSA-N
Molecular Weight 229.279 g/mol
SMILES N1[C@]2([C@@](C(c3c(C1=O)cccc3)=O)(CCCC2)[H])[H]
SPLASH splash10-0002-0940000000-10a9c9663467d33680c5
Source of Spectrum U1-2002-1907-1
Wiley ID 1522634