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7-[2'-(1"-Methyl-2"-phenylethylamino)propyl]-theophilline
SpectraBase Compound ID 1W9dQSafwcQ
InChI InChI=1S/C19H25N5O2/c1-13(10-15-8-6-5-7-9-15)21-14(2)11-24-12-20-17-16(24)18(25)23(4)19(26)22(17)3/h5-9,12-14,21H,10-11H2,1-4H3
InChIKey CYWYUYISKCGNTK-UHFFFAOYSA-N
Mol Weight 355.44 g/mol
Molecular Formula C19H25N5O2
Exact Mass 355.200825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVMW17thaaD
Name 7-[2'-(1"-Methyl-2"-phenylethylamino)propyl]-theophilline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25N5O2
InChI InChI=1S/C19H25N5O2/c1-13(10-15-8-6-5-7-9-15)21-14(2)11-24-12-20-17-16(24)18(25)23(4)19(26)22(17)3/h5-9,12-14,21H,10-11H2,1-4H3
InChIKey CYWYUYISKCGNTK-UHFFFAOYSA-N
Molecular Weight 355.442 g/mol
SMILES N(C(C[n]1c2c(N(C(N(C)C2=O)=O)C)nc1)C)C(Cc1ccccc1)C
SPLASH splash10-03di-1290000000-86705027520368541be7
Source of Spectrum D8-324-545-3
Synonyms 1,3-Dimethyl-7-[2-[(1-methyl-2-phenyl-ethyl)amino]propyl]purine-2,6-dione 1,3-Dimethyl-7-[2-(1-phenylpropan-2-ylamino)propyl]purine-2,6-dione
Wiley ID 1514161