SpectraBase Compound ID | 3V1edhcGjGl |
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InChI | InChI=1S/C21H35N.C18H30O3S/c1-20(2,3)17-9-7-16(8-10-17)15-22-19-13-11-18(12-14-19)21(4,5)6;1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21/h7-10,18-19,22H,11-15H2,1-6H3;13-16H,2-12H2,1H3,(H,19,20,21) |
InChIKey | LMFXQWWPIUWJGW-UHFFFAOYSA-N |
Mol Weight | 628.01 g/mol |
Molecular Formula | C39H65NO3S |
Exact Mass | 627.468516 g/mol |
SpectraBase Spectrum ID | CuaTonhWDLL |
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Name | Benzenesulfonic acid, 4-dodecyl- N-(4-tert-butylphenyl-ethyl)-4-tert-butylcyclohexanammonium salt |
CAS Registry Number | 18777-56-5 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C39H65NO3S |
InChI | InChI=1S/C21H35N.C18H30O3S/c1-20(2,3)17-9-7-16(8-10-17)15-22-19-13-11-18(12-14-19)21(4,5)6;1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21/h7-10,18-19,22H,11-15H2,1-6H3;13-16H,2-12H2,1H3,(H,19,20,21) |
InChIKey | LMFXQWWPIUWJGW-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Technique | Film |