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2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-3-(hydroxymethyl)-7-methoxy-1-phenyl-, ethyl ester, (1.alpha.,2.beta.,3.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-3-(hydroxymethyl)-7-methoxy-1-phenyl-, ethyl ester, (1.alpha.,2.beta.,3.alpha.)-(.+-.)-
SpectraBase Compound ID GFpievzaa1h
InChI InChI=1S/C21H24O4/c1-3-25-21(23)20-16(13-22)11-15-9-10-17(24-2)12-18(15)19(20)14-7-5-4-6-8-14/h4-10,12,16,19-20,22H,3,11,13H2,1-2H3/t16-,19-,20-/m0/s1
InChIKey XEBTWSDYRZBVAO-VDGAXYAQSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J625VSNYALG
Name 2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-3-(hydroxymethyl)-7-methoxy-1-phenyl-, ethyl ester, (1.alpha.,2.beta.,3.alpha.)-(.+-.)-
Alternate Name(s) Ethyl (1S,2R,3R)-3-(hydroxymethyl)-7-methoxy-1-phenyl-1,2,3,4-tetrahydro-2-naphthalenecarboxylate Ethyl 1,2,3,4-tetrahydro-c-3-(hydroxymethyl)-7-methoxy-r-1-phenylnaphthalene-t-2-carboxylate
CAS Registry Number 120981-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-3-25-21(23)20-16(13-22)11-15-9-10-17(24-2)12-18(15)19(20)14-7-5-4-6-8-14/h4-10,12,16,19-20,22H,3,11,13H2,1-2H3/t16-,19-,20-/m0/s1
InChIKey XEBTWSDYRZBVAO-VDGAXYAQSA-N
Molecular Weight 340.419 g/mol
SMILES OC[C@@]1(Cc2c([C@@]([C@]1(C(=O)OCC)[H])(c1ccccc1)[H])cc(cc2)OC)[H]
SPLASH splash10-000g-3093000000-fd7e666357c4d46e0fcf
Source of Spectrum H-71-1700-12
Wiley ID 1335408