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5H-Cyclopenta[4,5]furo[2,3-d]-1,3-dioxole-6-carbonitrile, 7-(6-chloro-2-hexenyl)hexahydro-2,2-dimethyl-6-[(tributylstannyl)methyl]-, [3a.alpha.,4a.beta.,6.alpha.,7.alpha.(Z),7a.alpha.,7b.alpha.]-
SpectraBase Compound ID 88A5CigZlvy
InChI InChI=1S/C18H25ClNO3.3C4H9.Sn/c1-17(2)22-15-14-12(8-6-4-5-7-9-19)18(3,11-20)10-13(14)21-16(15)23-17;3*1-3-4-2;/h4,6,12-16H,3,5,7-10H2,1-2H3;3*1,3-4H2,2H3;/b6-4-;;;;/t12-,13-,14-,15-,16-,18-;;;;/m0..../s1
InChIKey YCCNREQDXXIRPA-JJCNMODNSA-N
Mol Weight 628.9 g/mol
Molecular Formula C30H52ClNO3Sn
Exact Mass 629.265774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cm2UB99DQXi
Name 5H-Cyclopenta[4,5]furo[2,3-d]-1,3-dioxole-6-carbonitrile, 7-(6-chloro-2-hexenyl)hexahydro-2,2-dimethyl-6-[(tributylstannyl)methyl]-, [3a.alpha.,4a.beta.,6.alpha.,7.alpha.(Z),7a.alpha.,7b.alpha.]-
CAS Registry Number 97430-84-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52ClNO3Sn
InChI InChI=1S/C18H25ClNO3.3C4H9.Sn/c1-17(2)22-15-14-12(8-6-4-5-7-9-19)18(3,11-20)10-13(14)21-16(15)23-17;3*1-3-4-2;/h4,6,12-16H,3,5,7-10H2,1-2H3;3*1,3-4H2,2H3;/b6-4-;;;;/t12-,13-,14-,15-,16-,18-;;;;/m0..../s1
InChIKey YCCNREQDXXIRPA-JJCNMODNSA-N
Molecular Weight 628.914 g/mol
SMILES [C@]1([C@]([C@@]2([C@@]3(OC(C)(C)O[C@@]3(O[C@]2(C1)[H])[H])[H])[H])(C\C=C/CCCCl)[H])(C#N)C[Sn](CCCC)(CCCC)CCCC
SPLASH splash10-00fr-0520090000-c7605d1109bc3f45dd60
Source of Spectrum J-50-3626-4
Synonyms (3aS,4aS,6S,7S,7aS,7bS)-7-[(2Z)-6-chloro-2-hexenyl]-2,2-dimethyl-6-[(tributylstannyl)methyl]hexahydro-3aH-cyclopenta[4,5]furo[2,3-d][1,3]dioxole-6-carbonitrile
Wiley ID 1412041