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(10aR*,10bS*)-6a-aza-1,2,3,6,7,8,9,10,10a10b-decahydro-6-oxo-5-oxa-4-phenylcyclohepta[de]naphthalene
SpectraBase Compound ID Bod8A5sAoot
InChI InChI=1S/C18H21NO2/c20-18-19-12-5-4-7-13-10-6-11-15(16(13)19)17(21-18)14-8-2-1-3-9-14/h1-3,8-9,13,16H,4-7,10-12H2/t13-,16-/m0/s1
InChIKey FVOFSIKYLOBDSC-BBRMVZONSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrHunxGzEBM
Name (10aR*,10bS*)-6a-aza-1,2,3,6,7,8,9,10,10a10b-decahydro-6-oxo-5-oxa-4-phenylcyclohepta[de]naphthalene
CAS Registry Number 124943-99-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c20-18-19-12-5-4-7-13-10-6-11-15(16(13)19)17(21-18)14-8-2-1-3-9-14/h1-3,8-9,13,16H,4-7,10-12H2/t13-,16-/m0/s1
InChIKey FVOFSIKYLOBDSC-BBRMVZONSA-N
Molecular Weight 283.371 g/mol
SMILES C12=C(OC(N3[C@]2([C@](CCCC3)([H])CCC1)[H])=O)c1ccccc1
SPLASH splash10-001j-0890000000-32f4644d67ca56dc0ee6
Source of Spectrum J-55-1457-73
Synonyms (8aR,11bS)-1-phenyl-5,6,7,8,8a,10,11,11b-octahydro-9H-[1,3]oxazino[5,4,3-jk][1]benzazepin-3-one
Wiley ID 1287158