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5H-Cyclopenta[d]pyridazin-1-amine, N-2,3-hexadienyl-6,7-dihydro-5,7-dimethyl-4-(methylsulfonyl)-
SpectraBase Compound ID 1xSpNMcmCg7
InChI InChI=1S/C16H23N3O2S/c1-5-6-7-8-9-17-15-13-11(2)10-12(3)14(13)16(19-18-15)22(4,20)21/h6,8,11-12H,5,9-10H2,1-4H3,(H,17,18)
InChIKey CWVONBMHQSVRMW-UHFFFAOYSA-N
Mol Weight 321.44 g/mol
Molecular Formula C16H23N3O2S
Exact Mass 321.151098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUM2m00NatY
Name 5H-Cyclopenta[d]pyridazin-1-amine, N-2,3-hexadienyl-6,7-dihydro-5,7-dimethyl-4-(methylsulfonyl)-
Alternate Name(s) (5R(*),7R(*))-N-2,3-hexadienyl-6,7-dihydro-4-(methylsulfonyl)-5,7-dimethyl-5H-cyclopenta[d]pyridazin-1-amine (5R(*),7S(*))-N-2,3-hexadienyl-6,7-dihydro-4-(methylsulfonyl)-5,7-dimethyl-5H-cyclopenta[d]pyridazin-1-amine N-(2,3-hexadienyl)-5,7-dimethyl-4-(methylsulfonyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-amine N-[5,7-dimethyl-4-(methylsulfonyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl]-N-(2,3-hexadienyl)amine
CAS Registry Number 133523-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23N3O2S
InChI InChI=1S/C16H23N3O2S/c1-5-6-7-8-9-17-15-13-11(2)10-12(3)14(13)16(19-18-15)22(4,20)21/h6,8,11-12H,5,9-10H2,1-4H3,(H,17,18)
InChIKey CWVONBMHQSVRMW-UHFFFAOYSA-N
Molecular Weight 321.439 g/mol
SMILES N(c1nnc(c2c1C(C)CC2C)S(=O)(=O)C)CC=C=CCC
SPLASH splash10-0a6u-9177000000-29b8630e52c4ddefbbf6
Source of Spectrum C-113-4233-12
Wiley ID 1320861