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3-isopropyl-9-phenyl-pyrimido[2,1-f]purin-7-one
SpectraBase Compound ID LHYF10JNh59
InChI InChI=1S/C17H15N5O/c1-11(2)21-9-18-15-16(21)19-10-22-14(23)8-13(20-17(15)22)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKey FUQVIABLKCRKNI-UHFFFAOYSA-N
Mol Weight 305.34 g/mol
Molecular Formula C17H15N5O
Exact Mass 305.12766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1e3PTVDWFs
Name 3-isopropyl-9-phenyl-pyrimido[2,1-f]purin-7-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N5O
InChI InChI=1S/C17H15N5O/c1-11(2)21-9-18-15-16(21)19-10-22-14(23)8-13(20-17(15)22)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKey FUQVIABLKCRKNI-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201801111
Molecular Weight 305.341 g/mol
Quality 97
Reported Formula C17H15N5O
SMILES C1(=CC=CC=C1)C=1N=C2N(C=NC3=C2N=CN3C(C)C)C(C1)=O
SPLASH splash10-0a70-0195000000-20d2d367dc2ffc2109b6
Source of Spectrum ACI-57-SM29-3pa (DOI: 10.1002/anie.201801111)
Wiley ID 1892999