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6'-[(o-Methoxyphenyl)methyl]-menthyl 3-hydroxybutyrate
SpectraBase Compound ID DSWcHgOKMzV
InChI InChI=1S/C21H30O4/c1-13(22)9-19(23)25-20-15(11-16-12-18(20)21(16,2)3)10-14-5-7-17(24-4)8-6-14/h5-8,13,15-16,18,20,22H,9-12H2,1-4H3/t13?,15-,16+,18+,20-/m1/s1
InChIKey QYZZVJBZJBAZHG-CSGHEGDCSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6jXm5kf7Wn
Name 6'-[(o-Methoxyphenyl)methyl]-menthyl 3-hydroxybutyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-13(22)9-19(23)25-20-15(11-16-12-18(20)21(16,2)3)10-14-5-7-17(24-4)8-6-14/h5-8,13,15-16,18,20,22H,9-12H2,1-4H3/t13?,15-,16+,18+,20-/m1/s1
InChIKey QYZZVJBZJBAZHG-CSGHEGDCSA-N
Molecular Weight 346.467 g/mol
SMILES OC(CC(O[C@]1([C@]2(C(C)(C)[C@](C2)(C[C@]1(Cc1ccc(cc1)OC)[H])[H])[H])[H])=O)C
SPLASH splash10-00dl-4920000000-6e46c9fbd23703222e3e
Source of Spectrum SK-30-466-10
Synonyms 3-Hydroxy-butyric acid (2R,3S)-3-(4-methoxy-benzyl)-6,6-dimethyl-bicyclo[3.1.1]hept-2-yl ester
Wiley ID 880999