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1H-Indeno[2,1-c]isoxazole, 3-(3,4-dimethoxyphenyl)-3,3a,8,8a-tetrahydro-5,6-dimethoxy-1-methyl-, (3.alpha.,3a.alpha.,8a.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

1H-Indeno[2,1-c]isoxazole, 3-(3,4-dimethoxyphenyl)-3,3a,8,8a-tetrahydro-5,6-dimethoxy-1-methyl-, (3.alpha.,3a.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID 5fNohTz90xR
InChI InChI=1S/C21H25NO5/c1-22-15-8-13-10-18(25-4)19(26-5)11-14(13)20(15)21(27-22)12-6-7-16(23-2)17(9-12)24-3/h6-7,9-11,15,20-21H,8H2,1-5H3/t15-,20+,21-/m0/s1
InChIKey LAUDJLZUKIDJLM-RVHYNSKXSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64Cy2RIENBZ
Name 1H-Indeno[2,1-c]isoxazole, 3-(3,4-dimethoxyphenyl)-3,3a,8,8a-tetrahydro-5,6-dimethoxy-1-methyl-, (3.alpha.,3a.alpha.,8a.alpha.)-(.+-.)-
Alternate Name(s) (3R,3aR,8aS)-3-(3,4-dimethoxyphenyl)-5,6-dimethoxy-1-methyl-3,3a,8,8a-tetrahydro-1H-indeno[2,1-c]isoxazole (3RS,3aRS,8aSR)-3-(3,4-dimethoxyphenyl)-5,6-dimethoxy-1-methyl-3,3a,8,8a-tetrahydro-1H-indeno[2,1-c]isoxazole
CAS Registry Number 74904-75-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO5
InChI InChI=1S/C21H25NO5/c1-22-15-8-13-10-18(25-4)19(26-5)11-14(13)20(15)21(27-22)12-6-7-16(23-2)17(9-12)24-3/h6-7,9-11,15,20-21H,8H2,1-5H3/t15-,20+,21-/m0/s1
InChIKey LAUDJLZUKIDJLM-RVHYNSKXSA-N
Molecular Weight 371.433 g/mol
SMILES [C@@]12([C@@](N(C)O[C@]2(c2cc(OC)c(cc2)OC)[H])(Cc2c1cc(c(OC)c2)OC)[H])[H]
SPLASH splash10-0ufr-0149000000-c57b6f168670fb90b09e
Source of Spectrum B-33-392-0
Wiley ID 1355004