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2-Amino-4-(4-butoxy-3,5-dimethoxyphenyl)-4H-naphtho(1,2-b)pyran-3-carbonitrile
SpectraBase Compound ID CCJtmQhYg55
InChI InChI=1S/C26H26N2O4/c1-4-5-12-31-25-21(29-2)13-17(14-22(25)30-3)23-19-11-10-16-8-6-7-9-18(16)24(19)32-26(28)20(23)15-27/h6-11,13-14,23H,4-5,12,28H2,1-3H3
InChIKey VXYALBNZTFRWKJ-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C26H26N2O4
Exact Mass 430.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mAtyDp6V4x
Name 2-Amino-4-(4-butoxy-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 C26H26N2O4
InChI InChI=1S/C26H26N2O4/c1-4-5-12-31-25-21(29-2)13-17(14-22(25)30-3)23-19-11-10-16-8-6-7-9-18(16)24(19)32-26(28)20(23)15-27/h6-11,13-14,23H,4-5,12,28H2,1-3H3
InChIKey VXYALBNZTFRWKJ-UHFFFAOYSA-N
Instrument Name Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.1021/acsmedchemlett.2c00403
Molecular Weight 430.504 g/mol
SMILES NC=1Oc2c3c(ccc2C(C1C#N)c1cc(c(c(c1)OC)OCCCC)OC)cccc3
SPLASH splash10-00di-2091300000-72940ddccb14c4973ecc
Source of Spectrum MCS-13-SM6-3d
Wiley ID 1882385