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6-Spiro-cyclopentane-8-mercapto-6,11-dihydro-5H-7a,9,10,11-tetraaza-cyclopenta[b]phenanthren-7-one
SpectraBase Compound ID 2EMPxzH89tZ
InChI InChI=1S/C17H16N4OS/c22-14-12-13(18-15-19-20-16(23)21(14)15)11-6-2-1-5-10(11)9-17(12)7-3-4-8-17/h1-2,5-6H,3-4,7-9H2,(H,18,19)(H,20,23)
InChIKey ABYJWFGJPGSJCN-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C17H16N4OS
Exact Mass 324.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbwELk54lJG
Name 6-Spiro-cyclopentane-8-mercapto-6,11-dihydro-5H-7a,9,10,11-tetraaza-cyclopenta[b]phenanthren-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4OS
InChI InChI=1S/C17H16N4OS/c22-14-12-13(18-15-19-20-16(23)21(14)15)11-6-2-1-5-10(11)9-17(12)7-3-4-8-17/h1-2,5-6H,3-4,7-9H2,(H,18,19)(H,20,23)
InChIKey ABYJWFGJPGSJCN-UHFFFAOYSA-N
Molecular Weight 324.402 g/mol
SMILES N1C2=C(C([n]3c(nnc13)S)=O)C1(Cc3ccccc23)CCCC1
SPLASH splash10-0089-1961000000-70f5ff8bc2fb0161afee
Wiley ID 1437653