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N-[9-Propionyl-2-(propionylamino)-9H-purin-6-yl]propanamide
SpectraBase Compound ID 433Qhj6vW8U
InChI InChI=1S/C14H18N6O3/c1-4-8(21)16-12-11-13(20(7-15-11)10(23)6-3)19-14(18-12)17-9(22)5-2/h7H,4-6H2,1-3H3,(H2,16,17,18,19,21,22)
InChIKey OKVWHUAHZFKHQW-UHFFFAOYSA-N
Mol Weight 318.34 g/mol
Molecular Formula C14H18N6O3
Exact Mass 318.144038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLH8D6vb96w
Name N-[9-Propionyl-2-(propionylamino)-9H-purin-6-yl]propanamide
Alternate Name(s) N-(2-propionamido-9-propionyl-purin-6-yl)propionamide N-[9-(1-oxopropyl)-2-(1-oxopropylamino)-6-purinyl]propanamide N-[9-propanoyl-2-(propanoylamino)purin-6-yl]propanamide Propanamide, N-[6-(1-oxopropylamino)-9-(1-oxopropyl)purin-2-yl]-
CAS Registry Number 327986-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N6O3
InChI InChI=1S/C14H18N6O3/c1-4-8(21)16-12-11-13(20(7-15-11)10(23)6-3)19-14(18-12)17-9(22)5-2/h7H,4-6H2,1-3H3,(H2,16,17,18,19,21,22)
InChIKey OKVWHUAHZFKHQW-UHFFFAOYSA-N
Molecular Weight 318.337 g/mol
SMILES N(c1nc2c(c(n1)NC(=O)CC)nc[n]2C(=O)CC)C(=O)CC
SPLASH splash10-0zfr-5950000000-3c9c90e7e6c2d3880d67
Source of Spectrum AD-0-2532-0
Wiley ID 1432275