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(1R,2R)-2-butyl-1-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester
SpectraBase Compound ID 6k88FRt8ZSm
InChI InChI=1S/C23H36O2/c1-9-10-11-16-14-17(16)21(24)25-20-18(22(3,4)5)12-15(2)13-19(20)23(6,7)8/h12-13,16-17H,9-11,14H2,1-8H3/t16-,17-/m1/s1
InChIKey LCTPUTGNCVFKAD-IAGOWNOFSA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzinpdcV3zc
Name (1R,2R)-2-butyl-1-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester
Alternate Name(s) (1R,2R)-2-butylcyclopropanecarboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester (2,6-ditert-butyl-4-methyl-phenyl) (1R,2R)-2-butylcyclopropane-1-carboxylate (2,6-ditert-butyl-4-methyl-phenyl) (1R,2R)-2-butylcyclopropanecarboxylate
CAS Registry Number 125641-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-9-10-11-16-14-17(16)21(24)25-20-18(22(3,4)5)12-15(2)13-19(20)23(6,7)8/h12-13,16-17H,9-11,14H2,1-8H3/t16-,17-/m1/s1
InChIKey LCTPUTGNCVFKAD-IAGOWNOFSA-N
Molecular Weight 344.539 g/mol
SMILES c1(OC([C@@]2(C[C@]2(CCCC)[H])[H])=O)c(C(C)(C)C)cc(cc1C(C)(C)C)C
SPLASH splash10-0a4i-9400000000-bf01af7a41164787adea
Source of Spectrum C-112-1911-4
Wiley ID 1338356