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3H,5H-4a,10a-Methano-1H-benzo[4,5]cyclohept[1,2-c]isoxazole, octahydro-1-(phenylmethyl)-, (3a.alpha.,4a.alpha.,8a.beta.,10a.alpha.)-(.+-.)-
SpectraBase Compound ID EyWtx8vDhW
InChI InChI=1S/C20H27NO/c1-2-6-16(7-3-1)13-21-20-11-9-17-8-4-5-10-19(17,15-20)12-18(20)14-22-21/h1-3,6-7,17-18H,4-5,8-15H2/t17-,18-,19-,20-/m0/s1
InChIKey UQJGWAKTCVQCRL-MUGJNUQGSA-N
Mol Weight 297.44 g/mol
Molecular Formula C20H27NO
Exact Mass 297.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JcfPCvjRbn
Name 3H,5H-4a,10a-Methano-1H-benzo[4,5]cyclohept[1,2-c]isoxazole, octahydro-1-(phenylmethyl)-, (3a.alpha.,4a.alpha.,8a.beta.,10a.alpha.)-(.+-.)-
CAS Registry Number 104265-31-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO
InChI InChI=1S/C20H27NO/c1-2-6-16(7-3-1)13-21-20-11-9-17-8-4-5-10-19(17,15-20)12-18(20)14-22-21/h1-3,6-7,17-18H,4-5,8-15H2/t17-,18-,19-,20-/m0/s1
InChIKey UQJGWAKTCVQCRL-MUGJNUQGSA-N
Molecular Weight 297.442 g/mol
SMILES [C@@]123N(OC[C@@]3(C[C@]3(C1)CCCC[C@]3(CC2)[H])[H])Cc1ccccc1
SPLASH splash10-0005-6090000000-937c3bc0e10c7d8c0da3
Source of Spectrum F-41-3487-16
Synonyms (1S,4S,9S,11R)-14-benzyl-13-oxa-14-azatetracyclo[7.5.1.0(1,11).0(4,9)]pentadecane N-Methyl-1-oxa-2,n(11',71'')-tricyclo[7.1.1.0(4',a')]dodecane-ethylamine
Wiley ID 1300381