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2-Amino-3,4,6,7,8,8a-hexahydro-5H-thieno[4,3,2-d,e]isoquinoline-3,5-dione
SpectraBase Compound ID CvwZ7ar7JNA
InChI InChI=1S/C10H10N2O2S/c11-8-7-6-4(9(13)12-10(7)14)2-1-3-5(6)15-8/h5H,1-3,11H2,(H,12,13,14)
InChIKey ADQHWAVVYJHEKX-UHFFFAOYSA-N
Mol Weight 222.26 g/mol
Molecular Formula C10H10N2O2S
Exact Mass 222.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kkQn1vUrLi
Name 2-Amino-3,4,6,7,8,8a-hexahydro-5H-thieno[4,3,2-d,e]isoquinoline-3,5-dione
Alternate Name(s) 2-amino-6,7,8,8a-tetrahydro-3H-thieno[4,3,2-de]isoquinoline-3,5(4H)-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N2O2S
InChI InChI=1S/C10H10N2O2S/c11-8-7-6-4(9(13)12-10(7)14)2-1-3-5(6)15-8/h5H,1-3,11H2,(H,12,13,14)
InChIKey ADQHWAVVYJHEKX-UHFFFAOYSA-N
Molecular Weight 222.262 g/mol
SMILES NC=1SC2CCCC3=C2C1C(NC3=O)=O
SPLASH splash10-00dl-0890000000-d358469e080e22bc44f2
Source of Spectrum H1-50-1103-7
Wiley ID 816941