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(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (2'R/S)-2'-isopropyl-4,4-dimethylpentanoate
SpectraBase Compound ID 41av7O7WlLW
InChI InChI=1S/C20H38O2/c1-13(2)16-10-9-15(5)11-18(16)22-19(21)17(14(3)4)12-20(6,7)8/h13-18H,9-12H2,1-8H3/t15-,16+,17?,18-/m1/s1
InChIKey VZQVWLTXQZAMNW-UJJTZGENSA-N
Mol Weight 310.5 g/mol
Molecular Formula C20H38O2
Exact Mass 310.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGHQXDrHydD
Name (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (2'R/S)-2'-isopropyl-4,4-dimethylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O2
InChI InChI=1S/C20H38O2/c1-13(2)16-10-9-15(5)11-18(16)22-19(21)17(14(3)4)12-20(6,7)8/h13-18H,9-12H2,1-8H3/t15-,16+,17?,18-/m1/s1
InChIKey VZQVWLTXQZAMNW-UJJTZGENSA-N
Instrument Name Finnigan MAT, Varian Saturn II
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.5
Molecular Weight 310.522 g/mol
SMILES C1[C@](C[C@]([C@@](C1)(C(C)C)[H])(OC(C(CC(C)(C)C)C(C)C)=O)[H])(C)[H]
SPLASH splash10-05a9-9700000000-ad4580fbf14ed53a4608
Sample Comments 5% de
Source of Spectrum BJO-13-SM14-21a/b
Wiley ID 1848316