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2-[(5-amino-6-chloro-4-pyrimidinyl)amino]-1,3-propanediol
SpectraBase Compound ID 3PNAM9AslfK
InChI InChI=1S/C7H11ClN4O2/c8-6-5(9)7(11-3-10-6)12-4(1-13)2-14/h3-4,13-14H,1-2,9H2,(H,10,11,12)
InChIKey DCVWUTDXGASBAI-UHFFFAOYSA-N
Mol Weight 218.64 g/mol
Molecular Formula C7H11ClN4O2
Exact Mass 218.057053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cuCQNJJNEa
Name 2-[(5-amino-6-chloro-4-pyrimidinyl)amino]-1,3-propanediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11ClN4O2
InChI InChI=1S/C7H11ClN4O2/c8-6-5(9)7(11-3-10-6)12-4(1-13)2-14/h3-4,13-14H,1-2,9H2,(H,10,11,12)
InChIKey DCVWUTDXGASBAI-UHFFFAOYSA-N
Molecular Weight 218.644 g/mol
SMILES Nc1c(ncnc1Cl)NC(CO)CO
SPLASH splash10-014u-8900000000-44647614537131fded7e
Synonyms Propane-1,3-diol, 2-(5-amino-6-chloropyrimidin-4-yl)amino- 2-[(5-amino-6-chloro-4-pyrimidinyl)amino]propane-1,3-diol 2-[(5-amino-6-chloropyrimidin-4-yl)amino]propane-1,3-diol 2-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]propane-1,3-diol
Wiley ID 1451071