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1H-5,9a-Methanocyclooct[c]isoxazole, octahydro-1-methyl-, (3a.alpha.,5.beta.,9a.beta.)-(.+-.)-
SpectraBase Compound ID JFAvoGewQqv
InChI InChI=1S/C11H19NO/c1-12-11-5-3-2-4-9(7-11)6-10(11)8-13-12/h9-10H,2-8H2,1H3/t9-,10?,11+/m1/s1
InChIKey SMXLTYVWGKRTQL-FBKFWFMHSA-N
Mol Weight 181.28 g/mol
Molecular Formula C11H19NO
Exact Mass 181.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMr57RVlrqG
Name 1H-5,9a-Methanocyclooct[c]isoxazole, octahydro-1-methyl-, (3a.alpha.,5.beta.,9a.beta.)-(.+-.)-
CAS Registry Number 104265-30-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19NO
InChI InChI=1S/C11H19NO/c1-12-11-5-3-2-4-9(7-11)6-10(11)8-13-12/h9-10H,2-8H2,1H3/t9-,10?,11+/m1/s1
InChIKey SMXLTYVWGKRTQL-FBKFWFMHSA-N
Molecular Weight 181.279 g/mol
SMILES [C@@]123N(OCC3C[C@](C1)(CCCC2)[H])C
SPLASH splash10-00di-2900000000-6632ae5c01ddaa7858ce
Source of Spectrum F-41-3487-15
Synonyms 1H-5,9a-methanocyclooct[c]isoxazole, octahydro-1-methyl-, 2-Methyl-3-oxa-2-azatricyclo[5.4.1.0(1,5)]dodecane
Wiley ID 1177623