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Azocine, 8-ethoxy-2,3,4,5-tetrahydro-7-(phenylsulfonyl)-, (E,?)-
SpectraBase Compound ID FCcK34Wduh1
InChI InChI=1S/C15H19NO3S/c1-2-19-15-14(11-7-4-8-12-16-15)20(17,18)13-9-5-3-6-10-13/h3,5-6,9-11H,2,4,7-8,12H2,1H3/b14-11+,16-15+
InChIKey SQSDNOQNUGSGNX-LPVXAABHSA-N
Mol Weight 293.38 g/mol
Molecular Formula C15H19NO3S
Exact Mass 293.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5Fa2YNlUwX
Name Azocine, 8-ethoxy-2,3,4,5-tetrahydro-7-(phenylsulfonyl)-, (E,?)-
Alternate Name(s) (E)-2-Ethoxy-3-phenylsulfonyl-5,6,7,8-tetrahydroazocine 2-Ethoxy-5,6,7,8-tetrahydro-3-azocinyl phenyl sulfone 8-Ethoxy-7-(phenylsulfonyl)-2,3,4,5-tetrahydroazocine
CAS Registry Number 105495-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO3S
InChI InChI=1S/C15H19NO3S/c1-2-19-15-14(11-7-4-8-12-16-15)20(17,18)13-9-5-3-6-10-13/h3,5-6,9-11H,2,4,7-8,12H2,1H3/b14-11+,16-15+
InChIKey SQSDNOQNUGSGNX-LPVXAABHSA-N
Molecular Weight 293.381 g/mol
SMILES C1\N=C/(\C(S(=O)(=O)c2ccccc2)=C/CCC1)OCC
SPLASH splash10-0ufr-4900000000-d414301b319831ba3d4b
Source of Spectrum B-39-694-11
Wiley ID 1296254