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4-Aza-5-thiatricyclo[5.2.1.0(3,7)]decane, 4-(2-butenoyl)-10,10-dimethyl-5,5-dioxo-
SpectraBase Compound ID G4FK4lfjayy
InChI InChI=1S/C14H21NO3S/c1-4-5-12(16)15-11-8-10-6-7-14(11,13(10,2)3)9-19(15,17)18/h4-5,10-11H,6-9H2,1-3H3/b5-4+/t10-,11-,14-/m1/s1
InChIKey BKPQKSSKLBTRJO-MNKRUUAMSA-N
Mol Weight 283.39 g/mol
Molecular Formula C14H21NO3S
Exact Mass 283.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FYTMqRsqsw
Name 4-Aza-5-thiatricyclo[5.2.1.0(3,7)]decane, 4-(2-butenoyl)-10,10-dimethyl-5,5-dioxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3S
InChI InChI=1S/C14H21NO3S/c1-4-5-12(16)15-11-8-10-6-7-14(11,13(10,2)3)9-19(15,17)18/h4-5,10-11H,6-9H2,1-3H3/b5-4+/t10-,11-,14-/m1/s1
InChIKey BKPQKSSKLBTRJO-MNKRUUAMSA-N
Molecular Weight 283.386 g/mol
SMILES C1S(=O)(N([C@]2([C@@]11CC[C@](C2)(C1(C)C)[H])[H])C(=O)\C=C\C)=O
SPLASH splash10-014i-9200000000-3548633ff5ace45a1240
Synonyms (1S,2R)-N-[(E)-[1-¹³C]crotonyl]bornane-10,2-sultam
Wiley ID 1501421