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E-(1R,2S,5R)-8-Phenylmenthyl 4-Hydroxyhept-2-enoate
SpectraBase Compound ID ZUjkBrFY1R
InChI InChI=1S/C23H34O3/c1-5-9-19(24)13-15-22(25)26-21-16-17(2)12-14-20(21)23(3,4)18-10-7-6-8-11-18/h6-8,10-11,13,15,17,19-21,24H,5,9,12,14,16H2,1-4H3/b15-13+/t17-,19?,20-,21-/m1/s1
InChIKey KHADKPFLVZNDDN-ZAKZCNIFSA-N
Mol Weight 358.5 g/mol
Molecular Formula C23H34O3
Exact Mass 358.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHff6dMdkqg
Name E-(1R,2S,5R)-8-Phenylmenthyl 4-Hydroxyhept-2-enoate
Alternate Name(s) (1R,2S,5R)-5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (2E)-4-hydroxy-2-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O3
InChI InChI=1S/C23H34O3/c1-5-9-19(24)13-15-22(25)26-21-16-17(2)12-14-20(21)23(3,4)18-10-7-6-8-11-18/h6-8,10-11,13,15,17,19-21,24H,5,9,12,14,16H2,1-4H3/b15-13+/t17-,19?,20-,21-/m1/s1
InChIKey KHADKPFLVZNDDN-ZAKZCNIFSA-N
Molecular Weight 358.522 g/mol
SMILES OC(\C=C\C(O[C@]1([C@](C(c2ccccc2)(C)C)(CC[C@@](C)(C1)[H])[H])[H])=O)CCC
SPLASH splash10-014i-0900000000-442fac8989073396c407
Source of Spectrum F-47-6611-2
Wiley ID 1347424