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2-Amino-6,7-tetramethylene-3,4-dihydro-7H-thieno[4,3,-c]pyridine-3,5-dione
SpectraBase Compound ID A0Wxh8cmEXH
InChI InChI=1S/C11H12N2O2S/c12-9-8-7-5(10(14)13-11(8)15)3-1-2-4-6(7)16-9/h6H,1-4,12H2,(H,13,14,15)
InChIKey KBZPKTGYBGXATD-UHFFFAOYSA-N
Mol Weight 236.29 g/mol
Molecular Formula C11H12N2O2S
Exact Mass 236.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27nk0epmHOh
Name 2-Amino-6,7-tetramethylene-3,4-dihydro-7H-thieno[4,3,-c]pyridine-3,5-dione
Alternate Name(s) 2-amino-7,8,9,9a-tetrahydro-1-thia-4-azabenzo[cd]azulene-3,5(4H,6H)-dione
Comments Less than 3 mono-isotopic peaks
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Formula C11H12N2O2S
InChI InChI=1S/C11H12N2O2S/c12-9-8-7-5(10(14)13-11(8)15)3-1-2-4-6(7)16-9/h6H,1-4,12H2,(H,13,14,15)
InChIKey KBZPKTGYBGXATD-UHFFFAOYSA-N
Molecular Weight 236.289 g/mol
SMILES NC=1SC2CCCCC3=C2C1C(NC3=O)=O
SPLASH splash10-004i-0940000000-507619a23317a1c41837
Source of Spectrum H1-50-1103-7
Wiley ID 816940