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1-dimethylamino-2-methyl-1,2,4,5,6,7-hexahydro-8-thia-2-aza-cyclopenta[a]inden-3-one
SpectraBase Compound ID K3iVFdHo8Pg
InChI InChI=1S/C13H18N2OS/c1-14(2)12-11-10(13(16)15(12)3)8-6-4-5-7-9(8)17-11/h12H,4-7H2,1-3H3
InChIKey ZWQZFKSOOJFMAK-UHFFFAOYSA-N
Mol Weight 250.36 g/mol
Molecular Formula C13H18N2OS
Exact Mass 250.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtScoLA0rK5
Name 1-dimethylamino-2-methyl-1,2,4,5,6,7-hexahydro-8-thia-2-aza-cyclopenta[a]inden-3-one
Appearance Light-yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.113984381 u
Formula C13H18N2OS
InChI InChI=1S/C13H18N2OS/c1-14(2)12-11-10(13(16)15(12)3)8-6-4-5-7-9(8)17-11/h12H,4-7H2,1-3H3
InChIKey ZWQZFKSOOJFMAK-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201048
Molecular Weight 250.360 g/mol
Quality 327
Reported Formula C13H18N2OS
SMILES C1=2C3=C(SC2CCCC1)C(N(C3=O)C)N(C)C
SPLASH splash10-00di-1290000000-c768694bf0b78a173834
Source of Spectrum K1-2022-SM179-25 (DOI: 10.1002/ejoc.202201048)
Wiley ID 1907908