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2,3,7,8-cis-Octahydropyridazino[1,2-a]pyridazine-2,3,7,8-tetrol, hydrate
SpectraBase Compound ID 3yY5sJLxwqx
InChI InChI=1S/C8H16N2O4.H2O/c11-5-1-9-2-7(13)8(14)4-10(9)3-6(5)12;/h5-8,11-14H,1-4H2;1H2/t5-,6+,7+,8-;
InChIKey KCSLQVIWUZOOPL-WTSYXZODSA-N
Mol Weight 222.241 g/mol
Molecular Formula C8H18N2O5
Exact Mass 222.121572 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FzCra1YFCm6
Name 2,3,7,8-cis-Octahydropyridazino[1,2-a]pyridazine-2,3,7,8-tetrol, hydrate
Source of Sample H. R. Meyer, Dewey & Almy A.G., Zurich, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18N2O5
InChI InChI=1S/C8H16N2O4.H2O/c11-5-1-9-2-7(13)8(14)4-10(9)3-6(5)12;/h5-8,11-14H,1-4H2;1H2/t5-,6+,7+,8-;
InChIKey KCSLQVIWUZOOPL-WTSYXZODSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 2925(1964)
Melting Point 304C (dec.)
Molecular Weight 222.241000
SMILES O[C@]1(CN2N(C[C@@]([C@@](C2)(O)[H])(O)[H])C[C@]1(O)[H])[H].O
Technique KBr WAFER