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2-Amino-4-(4-allyloxy-3,5-dimethoxyphenyl)-4H-naphtho(1,2-b)pyran-3-carbonitrile
SpectraBase Compound ID 93y704x26lr
InChI InChI=1S/C25H22N2O4/c1-4-11-30-24-20(28-2)12-16(13-21(24)29-3)22-18-10-9-15-7-5-6-8-17(15)23(18)31-25(27)19(22)14-26/h4-10,12-13,22H,1,11,27H2,2-3H3
InChIKey LOSDQHCJIMFLOV-UHFFFAOYSA-N
Mol Weight 414.46 g/mol
Molecular Formula C25H22N2O4
Exact Mass 414.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H3alLDJvpey
Name 2-Amino-4-(4-allyloxy-3,5-dimethoxyphenyl)-4H-naphtho(1,2-b)pyran-3-carbonitrile
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22N2O4
InChI InChI=1S/C25H22N2O4/c1-4-11-30-24-20(28-2)12-16(13-21(24)29-3)22-18-10-9-15-7-5-6-8-17(15)23(18)31-25(27)19(22)14-26/h4-10,12-13,22H,1,11,27H2,2-3H3
InChIKey LOSDQHCJIMFLOV-UHFFFAOYSA-N
Instrument Name Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.1021/acsmedchemlett.2c00403
Molecular Weight 414.461 g/mol
SMILES NC=1Oc2c3c(ccc2C(C1C#N)c1cc(c(c(c1)OC)OCC=C)OC)cccc3
SPLASH splash10-00di-0192100000-ec320eca9d5c9129b57e
Source of Spectrum MCS-13-SM6-3e
Wiley ID 1882386