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3,8,10-Trioxatetracyclo[4.3.1.0(2,4).0(7,9)]decan-1-ol, 5-chloro-, (1.alpha.,2.beta.,4.beta.,5.beta.,6.alpha.,7.beta.,9.beta.)-
SpectraBase Compound ID HAtR5uwmrne
InChI InChI=1S/C7H7ClO4/c8-1-2-4-6(11-4)7(9,12-2)5-3(1)10-5/h1-6,9H/t1-,2-,3-,4-,5+,6-,7+/m0/s1
InChIKey NNJYUPIINGPNSK-VXILYEKMSA-N
Mol Weight 190.58 g/mol
Molecular Formula C7H7ClO4
Exact Mass 190.003286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78yfAdfvOmr
Name 3,8,10-Trioxatetracyclo[4.3.1.0(2,4).0(7,9)]decan-1-ol, 5-chloro-, (1.alpha.,2.beta.,4.beta.,5.beta.,6.alpha.,7.beta.,9.beta.)-
CAS Registry Number 72985-63-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7ClO4
InChI InChI=1S/C7H7ClO4/c8-1-2-4-6(11-4)7(9,12-2)5-3(1)10-5/h1-6,9H/t1-,2-,3-,4-,5+,6-,7+/m0/s1
InChIKey NNJYUPIINGPNSK-VXILYEKMSA-N
Molecular Weight 190.582 g/mol
SMILES O[C@]12[C@@]3([C@]([H])([C@@](O2)([C@](Cl)([C@]2([C@]1(O2)[H])[H])[H])[H])O3)[H]
SPLASH splash10-0600-5900000000-9ccaa33b941fa1575b64
Source of Spectrum K-117-1848-0
Synonyms (1S,2R,4R,5R,6R,7R,9S)-5-chloro-3,8,10-trioxatetracyclo[4.3.1.0(2,4).0(7,9)]decan-1-ol DL-(1.alpha.,2.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,9.alpha.)-5-chloro-3,8,10-trioxatetracyclo[4.3.1.0(2,4).0(7,9)]decan-1-ole
Wiley ID 1186067