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(syn-2,4)-4-(N-Acetylbenzylamino)-2-isobutoxy-6-phenyl-2,4-dihydro-2H-pyran-5-carbonitrile
SpectraBase Compound ID 4vObhMIyCUM
InChI InChI=1S/C25H28N2O3/c1-4-18(2)29-24-15-23(27(19(3)28)17-20-11-7-5-8-12-20)22(16-26)25(30-24)21-13-9-6-10-14-21/h5-14,18,23-24H,4,15,17H2,1-3H3/t18?,23-,24-/m1/s1
InChIKey OLQWXUVANRJPBI-VBTAZDKBSA-N
Mol Weight 404.51 g/mol
Molecular Formula C25H28N2O3
Exact Mass 404.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSiPFHsynkc
Name (syn-2,4)-4-(N-Acetylbenzylamino)-2-isobutoxy-6-phenyl-2,4-dihydro-2H-pyran-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O3
InChI InChI=1S/C25H28N2O3/c1-4-18(2)29-24-15-23(27(19(3)28)17-20-11-7-5-8-12-20)22(16-26)25(30-24)21-13-9-6-10-14-21/h5-14,18,23-24H,4,15,17H2,1-3H3/t18?,23-,24-/m1/s1
InChIKey OLQWXUVANRJPBI-VBTAZDKBSA-N
Molecular Weight 404.510 g/mol
SMILES C=1([C@](N(C(=O)C)Cc2ccccc2)(C[C@@](OC1c1ccccc1)(OC(CC)C)[H])[H])C#N
SPLASH splash10-0229-0193100000-0deacd9e690bb0c3569b
Source of Spectrum AH-126-1347-5
Synonyms N-benzyl-N-[(2R,4R)-2-sec-butoxy-5-cyano-6-phenyl-3,4-dihydro-2H-pyran-4-yl]acetamide
Wiley ID 1371488