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tert-Butyl (4R)-4-[3-hydroxy-3-(3,4,5-trimethoxyphenyl)-1-propynyl]-2,2-dimethyl-1,3-oxazolane-3-carboxylate
SpectraBase Compound ID 9ux1aHKJEnO
InChI InChI=1S/C22H31NO7/c1-21(2,3)30-20(25)23-15(13-29-22(23,4)5)9-10-16(24)14-11-17(26-6)19(28-8)18(12-14)27-7/h11-12,15-16,24H,13H2,1-8H3/t15-,16?/m1/s1
InChIKey QORGGBYDTUAEAU-AAFJCEBUSA-N
Mol Weight 421.49 g/mol
Molecular Formula C22H31NO7
Exact Mass 421.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5ZtkUpFwIl
Name tert-Butyl (4R)-4-[3-hydroxy-3-(3,4,5-trimethoxyphenyl)-1-propynyl]-2,2-dimethyl-1,3-oxazolane-3-carboxylate
Alternate Name(s) tert-Butyl (4R)-4-[3-hydroxy-3-(3,4,5-trimethoxyphenyl)-1-propynyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO7
InChI InChI=1S/C22H31NO7/c1-21(2,3)30-20(25)23-15(13-29-22(23,4)5)9-10-16(24)14-11-17(26-6)19(28-8)18(12-14)27-7/h11-12,15-16,24H,13H2,1-8H3/t15-,16?/m1/s1
InChIKey QORGGBYDTUAEAU-AAFJCEBUSA-N
Molecular Weight 421.490 g/mol
SMILES OC(c1cc(OC)c(c(c1)OC)OC)C#C[C@]1(N(C(OC(C)(C)C)=O)C(OC1)(C)C)[H]
SPLASH splash10-0a4i-9041300000-1af27e8b44a3f286030d
Source of Spectrum QC-10-3426-9
Wiley ID 871583