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Methyl (2'SR,4a'SR,8'RS,8a'RS)-2-(2'-Methyl-1'-(tosylhydrazono)-1',2',3',4',4a',5',8',8a'-octahydronaphthalen-8'-yl)acetate

View entire compound with spectra: 1 MS (GC)

Methyl (2'SR,4a'SR,8'RS,8a'RS)-2-(2'-Methyl-1'-(tosylhydrazono)-1',2',3',4',4a',5',8',8a'-octahydronaphthalen-8'-yl)acetate
SpectraBase Compound ID LN1xGKtIpJ
InChI InChI=1S/C21H28N2O4S/c1-14-7-11-18(12-8-14)28(25,26)23-22-21-15(2)9-10-16-5-4-6-17(20(16)21)13-19(24)27-3/h4,6-8,11-12,15-17,20-21H,5,9-10,13H2,1-3H3/b23-22+/t15-,16+,17-,20+,21?/m0/s1
InChIKey CYKHVCDBWRLDRB-KICBRLSTSA-N
Mol Weight 404.53 g/mol
Molecular Formula C21H28N2O4S
Exact Mass 404.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UmNDePVDo2
Name Methyl (2'SR,4a'SR,8'RS,8a'RS)-2-(2'-Methyl-1'-(tosylhydrazono)-1',2',3',4',4a',5',8',8a'-octahydronaphthalen-8'-yl)acetate
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Formula C21H28N2O4S
InChI InChI=1S/C21H28N2O4S/c1-14-7-11-18(12-8-14)28(25,26)23-22-21-15(2)9-10-16-5-4-6-17(20(16)21)13-19(24)27-3/h4,6-8,11-12,15-17,20-21H,5,9-10,13H2,1-3H3/b23-22+/t15-,16+,17-,20+,21?/m0/s1
InChIKey CYKHVCDBWRLDRB-KICBRLSTSA-N
Molecular Weight 404.525 g/mol
SMILES C1(\N=N\S(c2ccc(cc2)C)(=O)=O)[C@]2([C@](CC(=O)OC)(C=CC[C@@]2(CC[C@@]1(C)[H])[H])[H])[H]
SPLASH splash10-0032-2590100000-9874c150121d14c6b41c
Source of Spectrum F-55-10094-0
Wiley ID 838911