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5,5-Dimethyl-3-[(1E,3E)-3-methyl-4-(1-pyrrolidinyl)buta-1,3-dienyl]-4-phenyl-4-isoxazolol
SpectraBase Compound ID GKB47vOcmQY
InChI InChI=1S/C20H26N2O2/c1-16(15-22-13-7-8-14-22)11-12-18-20(23,19(2,3)24-21-18)17-9-5-4-6-10-17/h4-6,9-12,15,23H,7-8,13-14H2,1-3H3/b12-11+,16-15+
InChIKey TYSWNXXTFXGQMA-YBAIQQBHSA-N
Mol Weight 326.44 g/mol
Molecular Formula C20H26N2O2
Exact Mass 326.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZZLa7E5bR8
Name 5,5-Dimethyl-3-[(1E,3E)-3-methyl-4-(1-pyrrolidinyl)buta-1,3-dienyl]-4-phenyl-4-isoxazolol
CAS Registry Number 106808-33-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O2
InChI InChI=1S/C20H26N2O2/c1-16(15-22-13-7-8-14-22)11-12-18-20(23,19(2,3)24-21-18)17-9-5-4-6-10-17/h4-6,9-12,15,23H,7-8,13-14H2,1-3H3/b12-11+,16-15+
InChIKey TYSWNXXTFXGQMA-YBAIQQBHSA-N
Molecular Weight 326.440 g/mol
SMILES OC1(C(=NOC1(C)C)\C=C\C(=C\N1CCCC1)C)c1ccccc1
SPLASH splash10-0a4i-5490000000-02de0e63eb495a4f16b0
Source of Spectrum Y-26-1573-10
Synonyms 5,5-Dimethyl-3-[(1E,3E)-3-methyl-4-pyrrolidin-1-yl-buta-1,3-dienyl]-4-phenyl-1,2-oxazol-4-ol 5,5-Dimethyl-3-[(1E,3E)-3-methyl-4-pyrrolidin-1-yl-buta-1,3-dienyl]-4-phenyl-isoxazol-4-ol 5,5-Dimethyl-3-[(1E,3E)-3-methyl-4-pyrrolidino-buta-1,3-dienyl]-4-phenyl-2-isoxazolin-4-ol
Wiley ID 1325037