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6-(3-carboethoxyphenyl)-9-tetrahydropyranylpurine
SpectraBase Compound ID 5hQ2kyXDqb9
InChI InChI=1S/C19H20N4O3/c1-2-25-19(24)14-7-5-6-13(10-14)16-17-18(21-11-20-16)23(12-22-17)15-8-3-4-9-26-15/h5-7,10-12,15H,2-4,8-9H2,1H3
InChIKey STHSEBTZZUTMAL-UHFFFAOYSA-N
Mol Weight 352.39 g/mol
Molecular Formula C19H20N4O3
Exact Mass 352.153541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uKfZJo8efI
Name 6-(3-carboethoxyphenyl)-9-tetrahydropyranylpurine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N4O3
InChI InChI=1S/C19H20N4O3/c1-2-25-19(24)14-7-5-6-13(10-14)16-17-18(21-11-20-16)23(12-22-17)15-8-3-4-9-26-15/h5-7,10-12,15H,2-4,8-9H2,1H3
InChIKey STHSEBTZZUTMAL-UHFFFAOYSA-N
Molecular Weight 352.394 g/mol
SMILES c12[n](cnc2c(-c2cc(C(=O)OCC)ccc2)ncn1)C1OCCCC1
SPLASH splash10-00ks-9482000000-74524403d1434263e7f6
Source of Spectrum F-53-7252-21
Synonyms Ethyl 3-(9-tetrahydro-2H-pyran-2-yl-9H-purin-6-yl)benzoate 3-[9-(2-oxanyl)-6-purinyl]benzoic acid ethyl ester Ethyl 3-(9-tetrahydropyran-2-ylpurin-6-yl)benzoate Ethyl 3-[9-(oxan-2-yl)purin-6-yl]benzoate
Wiley ID 802199