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2,5a-Epoxy-3H-2-benzazepine, octahydro-, (2.alpha.,5a.alpha.,9a.beta.)-(.+-.)-
SpectraBase Compound ID Lh4sKIu1GGD
InChI InChI=1S/C10H17NO/c1-2-5-10-6-3-7-11(12-10)8-9(10)4-1/h9H,1-8H2/t9-,10-/m1/s1
InChIKey PFADVROBROSXID-NXEZZACHSA-N
Mol Weight 167.25 g/mol
Molecular Formula C10H17NO
Exact Mass 167.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9q2zOQb87Ae
Name 2,5a-Epoxy-3H-2-benzazepine, octahydro-, (2.alpha.,5a.alpha.,9a.beta.)-(.+-.)-
CAS Registry Number 89398-20-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO
InChI InChI=1S/C10H17NO/c1-2-5-10-6-3-7-11(12-10)8-9(10)4-1/h9H,1-8H2/t9-,10-/m1/s1
InChIKey PFADVROBROSXID-NXEZZACHSA-N
Molecular Weight 167.252 g/mol
SMILES [C@@]123ON(C[C@]3(CCCC1)[H])CCC2
SPLASH splash10-0006-9200000000-441b84df8a460bda4a25
Source of Spectrum J-49-1691-0
Synonyms (1R,6R)-12-oxa-8-azatricyclo[6.3.1.0(1,6)]dodecane (2.alpha.,5a.alpha.,9a.beta.)-(.+-.)-Octahydro-2,5a-epoxy-3H-2-benzazepine
Wiley ID 1163697