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tert-Butyl 2-{1-[chloro(p-tolylsulfinyl)methyl]cyclopentadecyl}propionate
SpectraBase Compound ID ELwljnqJYVC
InChI InChI=1S/C30H49ClO3S/c1-24-18-20-26(21-19-24)35(33)28(31)30(25(2)27(32)34-29(3,4)5)22-16-14-12-10-8-6-7-9-11-13-15-17-23-30/h18-21,25,28H,6-17,22-23H2,1-5H3
InChIKey AYJNBVHWFLTYPA-UHFFFAOYSA-N
Mol Weight 525.2 g/mol
Molecular Formula C30H49ClO3S
Exact Mass 524.309094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiySp3PXK7S
Name tert-Butyl 2-{1-[chloro(p-tolylsulfinyl)methyl]cyclopentadecyl}propionate
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Formula C30H49ClO3S
InChI InChI=1S/C30H49ClO3S/c1-24-18-20-26(21-19-24)35(33)28(31)30(25(2)27(32)34-29(3,4)5)22-16-14-12-10-8-6-7-9-11-13-15-17-23-30/h18-21,25,28H,6-17,22-23H2,1-5H3
InChIKey AYJNBVHWFLTYPA-UHFFFAOYSA-N
Molecular Weight 525.232 g/mol
SMILES C(C1(C(C(OC(C)(C)C)=O)C)CCCCCCCCCCCCCC1)(S(c1ccc(cc1)C)=O)Cl
SPLASH splash10-05ox-5192000000-01fb76e3199fd3a5bcd4
Source of Spectrum F-59-4332-8c
Wiley ID 1678090