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(+)-(S,Z)-N-methoxy-N-methyl-4-(1-(2-nitrophenylsulfonyl)-1,2,3,6,7,8-hexahydroazocin-2-yl)butanamide
SpectraBase Compound ID IyndufqXsTW
InChI InChI=1S/C19H27N3O6S/c1-20(28-2)19(23)14-9-11-16-10-5-3-4-8-15-21(16)29(26,27)18-13-7-6-12-17(18)22(24)25/h3,5-7,12-13,16H,4,8-11,14-15H2,1-2H3/b5-3-/t16-/m1/s1
InChIKey PKVIRIRKBCXUOY-OICCZTGUSA-N
Mol Weight 425.5 g/mol
Molecular Formula C19H27N3O6S
Exact Mass 425.162057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7r3aZEycdZ6
Name (+)-(S,Z)-N-methoxy-N-methyl-4-(1-(2-nitrophenylsulfonyl)-1,2,3,6,7,8-hexahydroazocin-2-yl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27N3O6S
InChI InChI=1S/C19H27N3O6S/c1-20(28-2)19(23)14-9-11-16-10-5-3-4-8-15-21(16)29(26,27)18-13-7-6-12-17(18)22(24)25/h3,5-7,12-13,16H,4,8-11,14-15H2,1-2H3/b5-3-/t16-/m1/s1
InChIKey PKVIRIRKBCXUOY-OICCZTGUSA-N
Literature Reference DOI 10.1002/asia.200700288
Molecular Weight 425.500 g/mol
SMILES C1N(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@](C\C=C/CC1)(CCCC(=O)N(C)OC)[H]
SPLASH splash10-000i-1791000000-d4146f9a7380329a8a0a
Source of Spectrum CAJ-3-316-20
Synonyms (S,Z)-N-methoxy-N-methyl-4-(1-((2-nitrophenyl)sulfonyl)-1,2,3,6,7,8-hexahydroazocin-2-yl)butanamide
Wiley ID 1774545