For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl 7-hydroxy-7-methyl-5-phenyl-4,5,6,7-tetrahydro[1,2,4]riazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID DVpqSSvK949
InChI InChI=1S/C14H16N4O3/c1-14(20)10(12(19)21-2)11(9-6-4-3-5-7-9)17-13-15-8-16-18(13)14/h3-8,10-11,20H,1-2H3,(H,15,16,17)/t10-,11+,14+/m0/s1
InChIKey JCAVPFGXTWCWOC-MISXGVKJSA-N
Mol Weight 288.31 g/mol
Molecular Formula C14H16N4O3
Exact Mass 288.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2cWiRH7Tcqh
Name Methyl 7-hydroxy-7-methyl-5-phenyl-4,5,6,7-tetrahydro[1,2,4]riazolo[1,5-a]pyrimidine-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N4O3
InChI InChI=1S/C14H16N4O3/c1-14(20)10(12(19)21-2)11(9-6-4-3-5-7-9)17-13-15-8-16-18(13)14/h3-8,10-11,20H,1-2H3,(H,15,16,17)/t10-,11+,14+/m0/s1
InChIKey JCAVPFGXTWCWOC-MISXGVKJSA-N
Molecular Weight 288.307 g/mol
SMILES N1[C@@]([C@]([C@@]([n]2c1ncn2)(C)O)(C(OC)=O)[H])(c1ccccc1)[H]
SPLASH splash10-00e9-0940000000-b3cd35083fd984d72b34
Source of Spectrum RSA-2-6726-14a
Synonyms (5S,6R,7R)-methyl 7-hydroxy-7-methyl-5-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Wiley ID 1747814