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3H-3a,6-Methano-2,1-benzisothiazole, hexahydro-8,8-dimethyl-1-(1-oxo-2-butenyl)-, 2,2-dioxide, [3aS-[1(Z),3a.alpha.,6.alpha.,7a.beta.]]-
SpectraBase Compound ID 5OtVk2y6R6F
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+/m0/s1
InChIKey BKPQKSSKLBTRJO-FSBZBJAHSA-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 LRdot5gyiWm
Name 3H-3a,6-Methano-2,1-benzisothiazole, hexahydro-8,8-dimethyl-1-(1-oxo-2-butenyl)-, 2,2-dioxide, [3aS-[1(Z),3a.alpha.,6.alpha.,7a.beta.]]-
CAS Registry Number 115014-91-0
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+/m0/s1
InChIKey BKPQKSSKLBTRJO-FSBZBJAHSA-N
Molecular Weight 283.386 g/mol
SMILES [C@@]12(N(S(C[C@@]11C([C@](C2)(CC1)[H])(C)C)(=O)=O)C(\C=C\C)=O)[H]
SPLASH splash10-014i-9000000000-f43a3a65631d5884c644
Source of Spectrum H-70-1671-2
Synonyms 3H-3a,6-Methano-2,1-benzisothiazole, hexahydro-8,8-dimethyl-1-(1-oxo-2-butenyl)-, 2,2-dioxide, [3aS-(1E,3a.alpha.,6.alpha.,7a.beta.)]- (1S,5R,7S)-4-[(2E)-2-butenoyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide n-Butenoyl-10,10-dimethyl-1,7-methano-4-aza-5-thiabicyclo[4.3.0(3,7)]decane-S-dioxide N-[(E)-2-butenoyl]bornane-10,2-sultam N-[(Z)-2-butenoyl]bornane-10,2-sultam
Wiley ID 1286827