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N-(1-Adamantyl)-5-(1-adamantyl)acetoxymethyl-1,3-oxathiolane-2-imine
SpectraBase Compound ID FRSYNRLKtiZ
InChI InChI=1S/C26H37NO3S/c28-23(13-25-7-16-1-17(8-25)3-18(2-16)9-25)29-14-22-15-31-24(30-22)27-26-10-19-4-20(11-26)6-21(5-19)12-26/h16-22H,1-15H2/t16-,17?,18?,19-,20+,21-,22?,25?,26-
InChIKey LNXZEXQUQOAOMQ-WXZKWJTPSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO3S
Exact Mass 443.249415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sCx7YMBuAH
Name N-(1-Adamantyl)-5-(1-adamantyl)acetoxymethyl-1,3-oxathiolane-2-imine
Appearance White microcrystals
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Formula C26H37NO3S
InChI InChI=1S/C26H37NO3S/c28-23(13-25-7-16-1-17(8-25)3-18(2-16)9-25)29-14-22-15-31-24(30-22)27-26-10-19-4-20(11-26)6-21(5-19)12-26/h16-22H,1-15H2/t16-,17?,18?,19-,20+,21-,22?,25?,26-
InChIKey LNXZEXQUQOAOMQ-WXZKWJTPSA-N
Instrument Name Finnigan DSQ GC-MS
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0006.416
Molecular Weight 443.646 g/mol
SMILES C1(OC(SC1)=NC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])COC(CC12CC3CC(CC(C3)C1)C2)=O
SPLASH splash10-009l-5910000000-9d115e5b36a405c22764
Source of Spectrum ARK-2005-205-6c
Wiley ID 1873064