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(1E,5E,7R,8S,9R)-7,9-diacetoxy-8-isopropyl-5-methyl-cyclodeca-1,5-diene-1-carboxylic acid
SpectraBase Compound ID 9f8cNjywm1S
InChI InChI=1S/C19H28O6/c1-11(2)18-16(24-13(4)20)9-12(3)7-6-8-15(19(22)23)10-17(18)25-14(5)21/h8-9,11,16-18H,6-7,10H2,1-5H3,(H,22,23)/b12-9+,15-8+/t16-,17-,18-/m1/s1
InChIKey DMIGIXZMNGJDMW-JJRPHXORSA-N
Mol Weight 352.43 g/mol
Molecular Formula C19H28O6
Exact Mass 352.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2sSR5Qk8nF
Name (1E,5E,7R,8S,9R)-7,9-diacetoxy-8-isopropyl-5-methyl-cyclodeca-1,5-diene-1-carboxylic acid
Alternate Name(s) (1E,5E,7R,8S,9R)-7,9-diacetyloxy-5-methyl-8-propan-2-yl-1-cyclodeca-1,5-dienecarboxylic acid (1E,5E,7R,8S,9R)-7,9-diacetyloxy-5-methyl-8-propan-2-yl-cyclodeca-1,5-diene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O6
InChI InChI=1S/C19H28O6/c1-11(2)18-16(24-13(4)20)9-12(3)7-6-8-15(19(22)23)10-17(18)25-14(5)21/h8-9,11,16-18H,6-7,10H2,1-5H3,(H,22,23)/b12-9+,15-8+/t16-,17-,18-/m1/s1
InChIKey DMIGIXZMNGJDMW-JJRPHXORSA-N
Molecular Weight 352.427 g/mol
SMILES OC(\C=1C[C@]([C@@]([C@@](\C=C\(CCC/1)C)(OC(=O)C)[H])(C(C)C)[H])(OC(=O)C)[H])=O
SPLASH splash10-001v-2920000000-2b0b4b247bdb2a3422d5
Source of Spectrum X2-68-529-1
Wiley ID 1609506