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(R)-((R)-1-cyclohexenyl-3-methoxy-1-oxopropan-2-yl) 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
SpectraBase Compound ID 82xv4L5u24z
InChI InChI=1S/C20H23F3O5/c1-26-13-16(17(24)14-9-5-3-6-10-14)28-18(25)19(27-2,20(21,22)23)15-11-7-4-8-12-15/h4,7-9,11-12,16H,3,5-6,10,13H2,1-2H3/t16-,19-/m1/s1
InChIKey XAQXFYJNVHUIIX-VQIMIIECSA-N
Mol Weight 400.39 g/mol
Molecular Formula C20H23F3O5
Exact Mass 400.149758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SHHqElFCq
Name (R)-((R)-1-cyclohexenyl-3-methoxy-1-oxopropan-2-yl) 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Alternate Name(s) (R)-(R)-1-(cyclohex-1-en-1-yl)-3-methoxy-1-oxopropan-2-yl 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23F3O5
InChI InChI=1S/C20H23F3O5/c1-26-13-16(17(24)14-9-5-3-6-10-14)28-18(25)19(27-2,20(21,22)23)15-11-7-4-8-12-15/h4,7-9,11-12,16H,3,5-6,10,13H2,1-2H3/t16-,19-/m1/s1
InChIKey XAQXFYJNVHUIIX-VQIMIIECSA-N
Literature Reference DOI 10.1002/adsc.200700550
Molecular Weight 400.394 g/mol
SMILES c1(ccccc1)[C@](C(=O)O[C@@](C(C1=CCCCC1)=O)(COC)[H])(OC)C(F)(F)F
SPLASH splash10-053l-1900000000-e793c29b0d4212ec3c3a
Source of Spectrum ASC-350-759/SM13-13_1
Wiley ID 1766094