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5,8-Ethano-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione, tetrahydro-5,8-bis(2-hydroxyethyl)-2-methyl-
SpectraBase Compound ID Lsv4JsYnJXa
InChI InChI=1S/C13H21N3O4/c1-14-10(19)15-12(6-8-17)2-3-13(5-4-12,7-9-18)16(15)11(14)20/h17-18H,2-9H2,1H3/t12-,13+
InChIKey YEHNTVJCYFUEDB-BETUJISGSA-N
Mol Weight 283.33 g/mol
Molecular Formula C13H21N3O4
Exact Mass 283.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lnXUqvTDPt
Name 5,8-Ethano-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione, tetrahydro-5,8-bis(2-hydroxyethyl)-2-methyl-
Alternate Name(s) NSC 345092
CAS Registry Number 71647-48-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21N3O4
InChI InChI=1S/C13H21N3O4/c1-14-10(19)15-12(6-8-17)2-3-13(5-4-12,7-9-18)16(15)11(14)20/h17-18H,2-9H2,1H3/t12-,13+
InChIKey YEHNTVJCYFUEDB-BETUJISGSA-N
Molecular Weight 283.328 g/mol
SMILES OCC[C@@]12N3C(N(C(N3[C@](CCO)(CC2)CC1)=O)C)=O
SPLASH splash10-0536-9610000000-59355fb27d789aaed728
Source of Spectrum J-44-4238-0
Wiley ID 1286796