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Allyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID EeRRC29MvN4
InChI InChI=1S/C18H16N2O5/c1-3-6-22-18(21)15-10(2)25-17(20)12(8-19)16(15)11-4-5-13-14(7-11)24-9-23-13/h3-5,7,16H,1,6,9,20H2,2H3
InChIKey MHCDXJSXSBOJPR-UHFFFAOYSA-N
Mol Weight 340.34 g/mol
Molecular Formula C18H16N2O5
Exact Mass 340.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFIZgOXkA57
Name Allyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Alternate Name(s) 4H-Pyrane-3-carboxylic acid, 6-amino-5-cyano-4-(3,4-methylenedioxyphenyl)-2-methyl-, allyl ester 6-Amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid allyl ester 6-Amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid prop-2-enyl ester Prop-2-enyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Prop-2-enyl 6-azanyl-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
CAS Registry Number 341500-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O5
InChI InChI=1S/C18H16N2O5/c1-3-6-22-18(21)15-10(2)25-17(20)12(8-19)16(15)11-4-5-13-14(7-11)24-9-23-13/h3-5,7,16H,1,6,9,20H2,2H3
InChIKey MHCDXJSXSBOJPR-UHFFFAOYSA-N
Molecular Weight 340.335 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1cc2OCOc2cc1)C(=O)OCC=C)C
SPLASH splash10-0006-9520000000-e623a92feb62d9e03058
Source of Spectrum AD-0-2532-0
Wiley ID 1426635