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4-Aza-5-thiatricyclo[5.2.1.0(3,7)]decane-5,5-dioxide, benzoyl-(7S)-10,10-dimethyl-
SpectraBase Compound ID L59kyXabPrK
InChI InChI=1S/C17H21NO3S/c1-16(2)13-8-9-17(16)11-22(20,21)18(14(17)10-13)15(19)12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3/t13-,14-,17-/m1/s1
InChIKey VJJAVFLZKJTZQJ-CKEIUWERSA-N
Mol Weight 319.42 g/mol
Molecular Formula C17H21NO3S
Exact Mass 319.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3myNLTWP2m
Name 4-Aza-5-thiatricyclo[5.2.1.0(3,7)]decane-5,5-dioxide, benzoyl-(7S)-10,10-dimethyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO3S
InChI InChI=1S/C17H21NO3S/c1-16(2)13-8-9-17(16)11-22(20,21)18(14(17)10-13)15(19)12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3/t13-,14-,17-/m1/s1
InChIKey VJJAVFLZKJTZQJ-CKEIUWERSA-N
Molecular Weight 319.419 g/mol
SMILES C1S(=O)(N([C@]2([C@@]11CC[C@](C2)(C1(C)C)[H])[H])C(=O)c1ccccc1)=O
SPLASH splash10-0a4i-3910000000-451649c50f3974399ce4
Wiley ID 1497373