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XCICWMZUANTLSZ-PLNGDYQASA-N
SpectraBase Compound ID 5lm01lFZ8h7
InChI InChI=1S/C17H17NO3S/c1-14-8-10-15(11-9-14)22(19,20)18-12-4-5-13-21-17-7-3-2-6-16(17)18/h2-11H,12-13H2,1H3/b5-4-
InChIKey XCICWMZUANTLSZ-PLNGDYQASA-N
Mol Weight 315.39 g/mol
Molecular Formula C17H17NO3S
Exact Mass 315.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26grsQyiHs3
Name 6-[(4-Methylphenyl)sulfonyl]-5,6-dihydro-2H-1,6-benzoxazocine
Alternate Name(s) (Z)-6-tosyl-5,6-dihydro-2H-benzo[b][1,4]oxazocine
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Formula C17H17NO3S
InChI InChI=1S/C17H17NO3S/c1-14-8-10-15(11-9-14)22(19,20)18-12-4-5-13-21-17-7-3-2-6-16(17)18/h2-11H,12-13H2,1H3/b5-4-
InChIKey XCICWMZUANTLSZ-PLNGDYQASA-N
Molecular Weight 315.387 g/mol
SMILES c12N(S(c3ccc(cc3)C)(=O)=O)C\C=C/COc1cccc2
SPLASH splash10-03di-3904000000-38d4abdcf4e2bf8686fe
Source of Spectrum F-69-2045-9j
Wiley ID 1737611