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Pyrazolidin-3-one-5-spiro[4'-thiacyclohexane]
SpectraBase Compound ID 5W0tHYJrNI1
InChI InChI=1S/C7H12N2OS/c10-6-5-7(9-8-6)1-3-11-4-2-7/h9H,1-5H2,(H,8,10)
InChIKey MXTODXLTBSHQIC-UHFFFAOYSA-N
Mol Weight 172.25 g/mol
Molecular Formula C7H12N2OS
Exact Mass 172.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIGb59ujEUW
Name Pyrazolidin-3-one-5-spiro[4'-thiacyclohexane]
CAS Registry Number 56700-46-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N2OS
InChI InChI=1S/C7H12N2OS/c10-6-5-7(9-8-6)1-3-11-4-2-7/h9H,1-5H2,(H,8,10)
InChIKey MXTODXLTBSHQIC-UHFFFAOYSA-N
Molecular Weight 172.246 g/mol
SMILES N1C(CC2(N1)CCSCC2)=O
SPLASH splash10-0gw3-9500000000-4b6cd5554148edbd3473
Source of Spectrum J-40-3508-0
Synonyms 8-Thia-1,2-diazaspiro[4.5]decan-3-one
Wiley ID 1168324