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6-Acetoxy-3,7-dimethyl-7-(4-acetoxymethyl-4-hydroxypentyl)-2-cycloheptene
SpectraBase Compound ID 4favWF06tCh
InChI InChI=1S/C19H32O5/c1-14-7-8-17(24-16(3)21)18(4,12-9-14)10-6-11-19(5,22)13-23-15(2)20/h9,17,22H,6-8,10-13H2,1-5H3/t17?,18-,19?/m1/s1
InChIKey VEMUDDDUHHGHQB-JLAWEPINSA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H32O5
Exact Mass 340.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzpUWe0bETM
Name 6-Acetoxy-3,7-dimethyl-7-(4-acetoxymethyl-4-hydroxypentyl)-2-cycloheptene
Alternate Name(s) 5-[7-(acetyloxy)-1,4-dimethyl-3-cyclohepten-1-yl]-2-hydroxy-2-methylpentyl acetate Acetic acid (R)-2-(5-acetoxy-4-hydroxy-4-methyl-pentyl)-2,5-dimethyl-cyclohept-4-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O5
InChI InChI=1S/C19H32O5/c1-14-7-8-17(24-16(3)21)18(4,12-9-14)10-6-11-19(5,22)13-23-15(2)20/h9,17,22H,6-8,10-13H2,1-5H3/t17?,18-,19?/m1/s1
InChIKey VEMUDDDUHHGHQB-JLAWEPINSA-N
Molecular Weight 340.460 g/mol
SMILES OC(CCC[C@]1(C(OC(=O)C)CCC(=CC1)C)C)(COC(=O)C)C
SPLASH splash10-053r-9620000000-4e11a7f26e26264dad2f
Source of Spectrum F-50-12668-24
Wiley ID 789962