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(1R,2S,5R)-(-)-Menthyl 2-Benzoyladamantane-2-carboxylate
SpectraBase Compound ID E8wJeynOAFt
InChI InChI=1S/C28H38O3/c1-17(2)24-10-9-18(3)11-25(24)31-27(30)28(26(29)21-7-5-4-6-8-21)22-13-19-12-20(15-22)16-23(28)14-19/h4-8,17-20,22-25H,9-16H2,1-3H3/t18-,19-,20+,22-,23+,24?,25?,28?/m1/s1
InChIKey UFCYXQSRTDENEP-SFXLNITNSA-N
Mol Weight 422.6 g/mol
Molecular Formula C28H38O3
Exact Mass 422.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8R66WyiFjqU
Name (1R,2S,5R)-(-)-Menthyl 2-Benzoyladamantane-2-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O3
InChI InChI=1S/C28H38O3/c1-17(2)24-10-9-18(3)11-25(24)31-27(30)28(26(29)21-7-5-4-6-8-21)22-13-19-12-20(15-22)16-23(28)14-19/h4-8,17-20,22-25H,9-16H2,1-3H3/t18-,19-,20+,22-,23+,24?,25?,28?/m1/s1
InChIKey UFCYXQSRTDENEP-SFXLNITNSA-N
Molecular Weight 422.609 g/mol
SMILES [C@]12(C([C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])(C(=O)OC1C(CC[C@](C1)(C)[H])C(C)C)C(c1ccccc1)=O)[H]
SPLASH splash10-0aor-4960000000-980903b374857d106d1b
Source of Spectrum F-67-8350-5
Synonyms (5R)-2-isopropyl-5-methylcyclohexyl 2-benzoyl-2-adamantanecarboxylate
Wiley ID 1571285