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4-Thia-2,6-diazahexacyclo[5.4.2.0(2,6).0(8,11).0(9,132).0(10,12)]tridecane-3,5-dione
SpectraBase Compound ID 71foHq0hQ6H
InChI InChI=1S/C10H8N2O2S/c13-9-11-7-3-1-2-5(3)8(6(2)4(1)7)12(11)10(14)15-9/h1-8H/t1-,2+,3-,4-,5+,6-,7+,8+/m1/s1
InChIKey HLUPNDQUSZZSBM-ZXRVBMDZSA-N
Mol Weight 220.25 g/mol
Molecular Formula C10H8N2O2S
Exact Mass 220.030649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bA3ur3Ki5Q
Name 4-Thia-2,6-diazahexacyclo[5.4.2.0(2,6).0(8,11).0(9,132).0(10,12)]tridecane-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2O2S
InChI InChI=1S/C10H8N2O2S/c13-9-11-7-3-1-2-5(3)8(6(2)4(1)7)12(11)10(14)15-9/h1-8H/t1-,2+,3-,4-,5+,6-,7+,8+/m1/s1
InChIKey HLUPNDQUSZZSBM-ZXRVBMDZSA-N
Molecular Weight 220.246 g/mol
SMILES C1(N2N(C(S1)=O)[C@]1([C@]3([C@]4([C@]2([C@]2([C@]1([C@@]3([C@@]42[H])[H])[H])[H])[H])[H])[H])[H])=O
SPLASH splash10-0v4i-0920000000-00da860c06757bfe93f9
Source of Spectrum J-59-3570-20
Synonyms 6-Thia-4,8-diazahexacyclo[7.4.0.0(2,12).0(3,11).0(4,8).0(10,13)]tridecane-5,7-dione
Wiley ID 1219405