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7-methyl-2-(3-nitrophenoxy)methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID LKKyjnvk23h
InChI InChI=1S/C13H10N4O4S/c1-8-5-12(18)16-13(14-8)22-11(15-16)7-21-10-4-2-3-9(6-10)17(19)20/h2-6H,7H2,1H3
InChIKey UISRLICYJAUHRH-UHFFFAOYSA-N
Mol Weight 318.31 g/mol
Molecular Formula C13H10N4O4S
Exact Mass 318.042276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YMwR1H0u5P
Name 7-methyl-2-(3-nitrophenoxy)methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4O4S
InChI InChI=1S/C13H10N4O4S/c1-8-5-12(18)16-13(14-8)22-11(15-16)7-21-10-4-2-3-9(6-10)17(19)20/h2-6H,7H2,1H3
InChIKey UISRLICYJAUHRH-UHFFFAOYSA-N
Molecular Weight 318.307 g/mol
SMILES C=12N(N=C(S2)COc2cc(N(=O)=O)ccc2)C(C=C(N1)C)=O
SPLASH splash10-014i-0009000000-3d1843374862309c8319
Source of Spectrum G2-19-219-6n
Wiley ID 1705393