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Spiro[1,3-dioxolane-2,8'(5'H)-[4H-4a,7]methanooxazirino[3,2-i][2,1]benzisothiazole], dihydro-9',9'-dimethyl-, 3',3'-dioxide, [2'R-(2'.alpha.,4'a.alpha.,7'.alpha.,8'aR*)]-
SpectraBase Compound ID BFpVDWI6k1h
InChI InChI=1S/C12H17NO5S/c1-9(2)8-3-4-10(9)7-19(14,15)13-12(10,18-13)11(8)16-5-6-17-11/h8H,3-7H2,1-2H3/t8-,10-,12+,13?/m0/s1
InChIKey WSWXURLXSDQRKJ-MQSSHQKBSA-N
Mol Weight 287.33 g/mol
Molecular Formula C12H17NO5S
Exact Mass 287.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uSq9vdGmk5
Name Spiro[1,3-dioxolane-2,8'(5'H)-[4H-4a,7]methanooxazirino[3,2-i][2,1]benzisothiazole], dihydro-9',9'-dimethyl-, 3',3'-dioxide, [2'R-(2'.alpha.,4'a.alpha.,7'.alpha.,8'aR*)]-
CAS Registry Number 131878-48-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO5S
InChI InChI=1S/C12H17NO5S/c1-9(2)8-3-4-10(9)7-19(14,15)13-12(10,18-13)11(8)16-5-6-17-11/h8H,3-7H2,1-2H3/t8-,10-,12+,13?/m0/s1
InChIKey WSWXURLXSDQRKJ-MQSSHQKBSA-N
Molecular Weight 287.330 g/mol
SMILES [C@]123N(S(=O)(=O)C[C@@]33C(C)(C)[C@@](C11OCCO1)(CC3)[H])O2
SPLASH splash10-001i-0930000000-758a8bbcf852d95bc978
Source of Spectrum KC-1990-2927-18
Synonyms (1'S,6'R)-11',11'-dimethyl-5'-oxa-3'-thia-4'-azaspiro[1,3-dioxolane-2,7'-tetracyclo[6.2.1.0(1,6).0(4,6)]undecane]-3',3'-dione (4aS,8aR)-9,9-dimethyl-6,7-dihydro-4H,5H,8H-4a,7-methano-oxazirino[3,2-i][2,1]benzisothiazole-8-spiro-2'-1',3'-dioxol-4H,5H,8H-4a,7-methano-oxazirino[3,2-i][2,1]benzidothiazole-8-spiro-2'-1',3'-dioxane 3,3-dioxide
Wiley ID 1290626