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(4R)-(all-E)-1-Ethylsulfanyl-4-isopropyl-1,7,11-trimethylcyclotetradeca-2,7,11-triene
SpectraBase Compound ID BhbQFhq0yIx
InChI InChI=1S/C22H38S/c1-7-23-22(6)16-9-12-19(4)10-8-11-20(5)13-14-21(15-17-22)18(2)3/h11-12,15,17-18,21H,7-10,13-14,16H2,1-6H3/b17-15+,19-12+,20-11+/t21-,22?/m0/s1
InChIKey AEDMBESATKMALX-IHRRRGHFSA-N
Mol Weight 334.6 g/mol
Molecular Formula C22H38S
Exact Mass 334.269422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJ9bV7lsFe
Name (4R)-(all-E)-1-Ethylsulfanyl-4-isopropyl-1,7,11-trimethylcyclotetradeca-2,7,11-triene
Alternate Name(s) (12R)-9-(ethylsulfanyl)-12-isopropyl-1,5,9-trimethyl-1,5,10-cyclotetradecatriene (all-E)-1-Ethylsulfanyl-4-isopropyl-1,7,11-trimethylcyclotetradeca-2,7,11-triene Ethyl (4R)-4-isopropyl-1,7,11-trimethyl-2,7,11-cyclotetradecatrien-1-yl sulfide
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Formula C22H38S
InChI InChI=1S/C22H38S/c1-7-23-22(6)16-9-12-19(4)10-8-11-20(5)13-14-21(15-17-22)18(2)3/h11-12,15,17-18,21H,7-10,13-14,16H2,1-6H3/b17-15+,19-12+,20-11+/t21-,22?/m0/s1
InChIKey AEDMBESATKMALX-IHRRRGHFSA-N
Molecular Weight 334.606 g/mol
SMILES C1(\C=C\[C@](CC\C(=C\CC\C(=C\CC1)C)C)(C(C)C)[H])(SCC)C
SPLASH splash10-00fr-0090000000-005d1433d76cb47dbcd3
Source of Spectrum KC-0-59-10
Wiley ID 784817