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2-Oxa-6-azatricyclo[3.3.1.1(3,7)]decane-4,8-diol, 6-(phenylsulfonyl)-, diacetate (ester), (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.,8.alpha.)-
SpectraBase Compound ID 5wdkcVJpVtr
InChI InChI=1S/C18H21NO7S/c1-10(20)24-17-13-8-16-18(25-11(2)21)14(9-15(17)26-16)19(13)27(22,23)12-6-4-3-5-7-12/h3-7,13-18H,8-9H2,1-2H3/t13-,14-,15-,16-,17+,18+/m1/s1
InChIKey ADVWIINBSVVABT-UHFFFAOYSA-N
Mol Weight 395.43 g/mol
Molecular Formula C18H21NO7S
Exact Mass 395.103873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvLftPZqr4E
Name 2-Oxa-6-azatricyclo[3.3.1.1(3,7)]decane-4,8-diol, 6-(phenylsulfonyl)-, diacetate (ester), (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.,8.alpha.)-
CAS Registry Number 50267-35-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO7S
InChI InChI=1S/C18H21NO7S/c1-10(20)24-17-13-8-16-18(25-11(2)21)14(9-15(17)26-16)19(13)27(22,23)12-6-4-3-5-7-12/h3-7,13-18H,8-9H2,1-2H3/t13-,14-,15-,16-,17+,18+/m1/s1
InChIKey ADVWIINBSVVABT-UHFFFAOYSA-N
Molecular Weight 395.426 g/mol
SMILES [C@]12([C@@]([C@@]3(O[C@](C2)([C@]([C@](N1S(=O)(=O)c1ccccc1)(C3)[H])(OC(C)=O)[H])[H])[H])(OC(C)=O)[H])[H]
SPLASH splash10-002f-9242000000-f2af2078f0e4f6b5501f
Source of Spectrum H-56-1983-34
Wiley ID 1366978