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2-[[4,8-bis[(phenylmethyl)amino]-2-pyrimido[5,4-d]pyrimidinyl]amino]ethanol

View entire compound with spectra: 1 MS (GC)

2-[[4,8-bis[(phenylmethyl)amino]-2-pyrimido[5,4-d]pyrimidinyl]amino]ethanol
SpectraBase Compound ID 40yQbo4ri6Y
InChI InChI=1S/C22H23N7O/c30-12-11-23-22-28-19-18(21(29-22)25-14-17-9-5-2-6-10-17)26-15-27-20(19)24-13-16-7-3-1-4-8-16/h1-10,15,30H,11-14H2,(H,24,26,27)(H2,23,25,28,29)
InChIKey KSLLGVWNGBCQND-UHFFFAOYSA-N
Mol Weight 401.47 g/mol
Molecular Formula C22H23N7O
Exact Mass 401.196408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bLAKmAhzJp
Name 2-[[4,8-bis[(phenylmethyl)amino]-2-pyrimido[5,4-d]pyrimidinyl]amino]ethanol
Alternate Name(s) 2-[[4,8-bis[(phenylmethyl)amino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23N7O
InChI InChI=1S/C22H23N7O/c30-12-11-23-22-28-19-18(21(29-22)25-14-17-9-5-2-6-10-17)26-15-27-20(19)24-13-16-7-3-1-4-8-16/h1-10,15,30H,11-14H2,(H,24,26,27)(H2,23,25,28,29)
InChIKey KSLLGVWNGBCQND-UHFFFAOYSA-N
Molecular Weight 401.474 g/mol
SMILES N(c1nc(nc2c(ncnc12)NCc1ccccc1)NCCO)Cc1ccccc1
SPLASH splash10-0f6x-9000700000-85b29d00ce3206bba41a
Source of Spectrum K-2002-114-6
Wiley ID 1580674