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(2S,1'R)-2-(4'-Methylenecyclohex-2'-en-1'-yl)propyl 4"-nitrobenzenesulfonate
SpectraBase Compound ID 1WqEpOIMkVG
InChI InChI=1S/C16H19NO5S/c1-12-3-5-14(6-4-12)13(2)11-22-23(20,21)16-9-7-15(8-10-16)17(18)19/h3,5,7-10,13-14H,1,4,6,11H2,2H3/t13-,14+/m1/s1
InChIKey FYVUKTHEGRNQIX-KGLIPLIRSA-N
Mol Weight 337.39 g/mol
Molecular Formula C16H19NO5S
Exact Mass 337.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fSe4Ky0fcg
Name (2S,1'R)-2-(4'-Methylenecyclohex-2'-en-1'-yl)propyl 4"-nitrobenzenesulfonate
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Formula C16H19NO5S
InChI InChI=1S/C16H19NO5S/c1-12-3-5-14(6-4-12)13(2)11-22-23(20,21)16-9-7-15(8-10-16)17(18)19/h3,5,7-10,13-14H,1,4,6,11H2,2H3/t13-,14+/m1/s1
InChIKey FYVUKTHEGRNQIX-KGLIPLIRSA-N
Molecular Weight 337.390 g/mol
SMILES C(OS(c1ccc(N(=O)=O)cc1)(=O)=O)[C@]([C@]1(C=CC(CC1)=C)[H])(C)[H]
SPLASH splash10-000x-7900000000-946e35fad7820125a348
Source of Spectrum H-82-1627-21
Synonyms (2S)-2-(4'-Methylenecyclohex-2'-en-1'-yl)propyl 4''-nitrobenzoate (2S)-2-(4'-Methylenecyclohex-2'-en-1'-yl)propyl 4''-nitrobenzoate (2S)-2-[(1R)-4-methylene-2-cyclohexen-1-yl]propyl 4-nitrobenzenesulfonate (2S,1'R)-2-(4'-Methylenecyclohex-2'-en-1'-yl)propyl 4''-nitrobenzenesulfonate 4-Nitrobenzenesulfonic acid[(2S)-2-[(1R)-4-methylene-1-cyclohex-2-enyl]propyl]ester 4-Nitrobenzenesulfonic acid[(2S)-2-[(1R)-4-methylenecyclohex-2-en-1-yl]propyl]ester [(2S)-2-[(1R)-4-methylenecyclohex-2-en-1-yl]propyl]4-nitrobenzenesulfonate [(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propyl]4-nitrobenzenesulfonate 4-Nitrobenzenesulfonic acid [(2S)-2-[(1R)-4-methylene-1-cyclohex-2-enyl]propyl] ester [(2S)-2-[(1R)-4-methylenecyclohex-2-en-1-yl]propyl] 4-nitrobenzenesulfonate [(2S)-2-[(1R)-4-methylidenecyclohex-2-en-1-yl]propyl] 4-nitrobenzenesulfonate
Wiley ID 815518