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3H-5,8a-methano-1H-cyclohept[c]isoxazole,hexhydro-1-(phenylmethyl)-,
SpectraBase Compound ID CTgOUNgQsA7
InChI InChI=1S/C16H21NO/c1-2-5-13(6-3-1)11-17-16-8-4-7-14(10-16)9-15(16)12-18-17/h1-3,5-6,14-15H,4,7-12H2
InChIKey CNRVPADXSAQESF-UHFFFAOYSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHKmUtXo9R3
Name 3H-5,8a-methano-1H-cyclohept[c]isoxazole,hexhydro-1-(phenylmethyl)-,
Alternate Name(s) 2-Benzyl-3-oxa-2-azatricyclo[5.3.1.0(1,5)]undecane
CAS Registry Number 104265-41-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-2-5-13(6-3-1)11-17-16-8-4-7-14(10-16)9-15(16)12-18-17/h1-3,5-6,14-15H,4,7-12H2
InChIKey CNRVPADXSAQESF-UHFFFAOYSA-N
Molecular Weight 243.350 g/mol
SMILES C123N(OCC3CC(C1)CCC2)Cc1ccccc1
SPLASH splash10-0006-9050000000-549d81fea2cd6181f34a
Source of Spectrum F-41-3487-22
Wiley ID 1246246