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2-amino-4-(3-(cyclopentyloxy)-4-methoxyphenyl)-6-phenyl-4H-pyran-3,5-dicarbonitrile
SpectraBase Compound ID KX33ZkBstk8
InChI InChI=1S/C25H23N3O3/c1-29-21-12-11-17(13-22(21)30-18-9-5-6-10-18)23-19(14-26)24(16-7-3-2-4-8-16)31-25(28)20(23)15-27/h2-4,7-8,11-13,18,23H,5-6,9-10,28H2,1H3
InChIKey MOTRARIOASXMQH-UHFFFAOYSA-N
Mol Weight 413.48 g/mol
Molecular Formula C25H23N3O3
Exact Mass 413.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fep2fiWb5jU
Name 2-amino-4-(3-(cyclopentyloxy)-4-methoxyphenyl)-6-phenyl-4H-pyran-3,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23N3O3
InChI InChI=1S/C25H23N3O3/c1-29-21-12-11-17(13-22(21)30-18-9-5-6-10-18)23-19(14-26)24(16-7-3-2-4-8-16)31-25(28)20(23)15-27/h2-4,7-8,11-13,18,23H,5-6,9-10,28H2,1H3
InChIKey MOTRARIOASXMQH-UHFFFAOYSA-N
Instrument Name HP 5989A
Ionization Type EI
Literature Reference DOI 10.1002_1097-0231(20001015)14_19_1783
Molecular Weight 413.477 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1ccc(OC)c(OC2CCCC2)c1)C#N)c1ccccc1
SPLASH splash10-0a4i-1901000000-a40a48b19adb8955b233
Source of Spectrum RCM-14-1784-2
Wiley ID 1839123