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all-cis-1,3-diacetoxytricyclo[6.4.0.0(2,7)]dodeca-3,11-diene
SpectraBase Compound ID 7xwa5M1TM9h
InChI InChI=1S/C16H20O4/c1-10(17)19-14-8-5-6-12-13-7-3-4-9-16(13,15(12)14)20-11(2)18/h4,8-9,12-13,15H,3,5-7H2,1-2H3/t12?,13?,15-,16+/m1/s1
InChIKey WUDHBYCVSCPJOO-GMEATFMZSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfFpKq0BSXh
Name all-cis-1,3-diacetoxytricyclo[6.4.0.0(2,7)]dodeca-3,11-diene
Alternate Name(s) (8aS,8bR)-8a-(acetyloxy)-3,4a,4b,5,6,8b-hexahydro-1(4H)-biphenylenyl acetate
CAS Registry Number 115018-93-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-10(17)19-14-8-5-6-12-13-7-3-4-9-16(13,15(12)14)20-11(2)18/h4,8-9,12-13,15H,3,5-7H2,1-2H3/t12?,13?,15-,16+/m1/s1
InChIKey WUDHBYCVSCPJOO-GMEATFMZSA-N
Molecular Weight 276.332 g/mol
SMILES [C@]12([C@]3(C(OC(=O)C)=CCCC3C2CCC=C1)[H])OC(=O)C
SPLASH splash10-0002-9200000000-c385ea93ebf4a1ca8a67
Source of Spectrum K-121-2003-17
Wiley ID 1280182