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Bicyclo[8.1.0]undeca-2,6-diene-4,5-diol, 3,7,11,11-tetramethyl-, diacetate, [1S-(1R*,2E,4R*,5R*,6E,10R*)]-
SpectraBase Compound ID CnIqWWDEoWI
InChI InChI=1S/C19H28O4/c1-11-7-8-15-16(19(15,5)6)10-12(2)18(23-14(4)21)17(9-11)22-13(3)20/h9-10,15-18H,7-8H2,1-6H3/b11-9-,12-10-
InChIKey BNSIPAGWPKHFGE-HWAYABPNSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LpbU8MRUKL
Name Bicyclo[8.1.0]undeca-2,6-diene-4,5-diol, 3,7,11,11-tetramethyl-, diacetate, [1S-(1R*,2E,4R*,5R*,6E,10R*)]-
Alternate Name(s) 2,3-Diacetoxybicyclogermacrene 4-(acetyloxy)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-dien-5-yl acetate
CAS Registry Number 86161-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-11-7-8-15-16(19(15,5)6)10-12(2)18(23-14(4)21)17(9-11)22-13(3)20/h9-10,15-18H,7-8H2,1-6H3/b11-9-,12-10-
InChIKey BNSIPAGWPKHFGE-HWAYABPNSA-N
Molecular Weight 320.429 g/mol
SMILES C12C(C)(C)C2CC\C(C)=C/C(C(\C(=C/1)C)OC(=O)C)OC(=O)C
SPLASH splash10-0k96-8920000000-d5fa7f664b37e590a9d9
Source of Spectrum AJ-56-1266-5
Wiley ID 1320288