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Tricyclo[5.3.1.1(2,6)]dodeca-3,8-diene-11,12-diol, 4,9-dichloro-, diacetate, (1.alpha.,2.beta.,6.beta.,7.alpha.,11R*,12S*)-
SpectraBase Compound ID DWILKgvr0zI
InChI InChI=1S/C16H18Cl2O4/c1-7(19)21-15-11-3-9(17)4-12(15)14-6-10(18)5-13(11)16(14)22-8(2)20/h3,6,11-16H,4-5H2,1-2H3/t11-,12+,13-,14+,15+,16+
InChIKey CGSSFMPREFJUGL-FRMPLNAESA-N
Mol Weight 345.22 g/mol
Molecular Formula C16H18Cl2O4
Exact Mass 344.058214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDtACmquriJ
Name Tricyclo[5.3.1.1(2,6)]dodeca-3,8-diene-11,12-diol, 4,9-dichloro-, diacetate, (1.alpha.,2.beta.,6.beta.,7.alpha.,11R*,12S*)-
CAS Registry Number 83098-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18Cl2O4
InChI InChI=1S/C16H18Cl2O4/c1-7(19)21-15-11-3-9(17)4-12(15)14-6-10(18)5-13(11)16(14)22-8(2)20/h3,6,11-16H,4-5H2,1-2H3/t11-,12+,13-,14+,15+,16+
InChIKey CGSSFMPREFJUGL-FRMPLNAESA-N
Molecular Weight 345.222 g/mol
SMILES [C@@]12([C@]([C@@]([H])([C@@]3([C@@]([C@]2(CC(=C3)Cl)[H])(OC(=O)C)[H])[H])CC(=C1)Cl)(OC(=O)C)[H])[H]
SPLASH splash10-01ti-4930000000-2a4b1551a0b23b460806
Source of Spectrum H-65-1017-0
Synonyms (1R,2S,6S,7R,11S,12R)-12-(acetyloxy)-4,9-dichlorotricyclo[5.3.1.1(2,6)]dodeca-3,8-dien-11-yl acetate [11anti,12-4,9-dichlorotricyclo[5.3.1.1(2,6)]dodeca-3,8-dien-11endo,12endo-diyl]diester of acetic acid
Wiley ID 1337678