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4,7-Epoxy-1,3-benzodioxole-5-carboxamide, 5-chlorohexahydro-2,2-dimethyl-, (3a.alpha.,4.beta.,5.alpha.,7.beta.,7a.alpha.)-
SpectraBase Compound ID Cq9loKzXIKN
InChI InChI=1S/C10H14ClNO4/c1-9(2)15-5-4-3-10(11,8(12)13)7(14-4)6(5)16-9/h4-7H,3H2,1-2H3,(H2,12,13)/t4-,5+,6+,7-,10+/m1/s1
InChIKey HTSCAZJJPXQUON-LJBZBAAHSA-N
Mol Weight 247.68 g/mol
Molecular Formula C10H14ClNO4
Exact Mass 247.061136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtLwpP147Q9
Name 4,7-Epoxy-1,3-benzodioxole-5-carboxamide, 5-chlorohexahydro-2,2-dimethyl-, (3a.alpha.,4.beta.,5.alpha.,7.beta.,7a.alpha.)-
CAS Registry Number 84424-32-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14ClNO4
InChI InChI=1S/C10H14ClNO4/c1-9(2)15-5-4-3-10(11,8(12)13)7(14-4)6(5)16-9/h4-7H,3H2,1-2H3,(H2,12,13)/t4-,5+,6+,7-,10+/m1/s1
InChIKey HTSCAZJJPXQUON-LJBZBAAHSA-N
Molecular Weight 247.678 g/mol
SMILES NC([C@]1([C@]2([C@]3(OC(C)(C)O[C@]3([C@](C1)([H])O2)[H])[H])[H])Cl)=O
SPLASH splash10-001i-0090000000-491b1480d5fed3bf8ac8
Source of Spectrum H-65-1705-0
Synonyms (1R,2S,6S,7R,8S)-8-chloro-4,4-dimethyl-3,5,10-trioxatricyclo[5.2.1.0(2,6)]decane-8-carboxamide 2-Chloro-5exo,6exo-isopropylidenedioxy-7-oxabicyclo[2.2.1]heptane-2-carboxamides
Wiley ID 1249744