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2-[4-(adamantan-1-yl)phenoxy]-N-(2H-1,3-benzodioxol-5-ylmethyl)acetamide
SpectraBase Compound ID AuCPVCGVqCP
InChI InChI=1S/C26H29NO4/c28-25(27-14-17-1-6-23-24(10-17)31-16-30-23)15-29-22-4-2-21(3-5-22)26-11-18-7-19(12-26)9-20(8-18)13-26/h1-6,10,18-20H,7-9,11-16H2,(H,27,28)/t18-,19+,20-,26-
InChIKey GOAKISBQMNENHA-VTTXJZCFSA-N
Mol Weight 419.52 g/mol
Molecular Formula C26H29NO4
Exact Mass 419.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Sn6FRNRn4d
Name 2-[4-(adamantan-1-yl)phenoxy]-N-(2H-1,3-benzodioxol-5-ylmethyl)acetamide
Alternate Name(s) Acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-(4-tricyclo[3.3.1.1(3,7)]dec-1-ylphenoxy)- 2-[4-(1-adamantyl)phenoxy]-N-(1,3-benzodioxol-5-ylmethyl)acetamide 2-[4-(1-adamantyl)phenoxy]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide
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Formula C26H29NO4
InChI InChI=1S/C26H29NO4/c28-25(27-14-17-1-6-23-24(10-17)31-16-30-23)15-29-22-4-2-21(3-5-22)26-11-18-7-19(12-26)9-20(8-18)13-26/h1-6,10,18-20H,7-9,11-16H2,(H,27,28)/t18-,19+,20-,26-
InChIKey GOAKISBQMNENHA-VTTXJZCFSA-N
Molecular Weight 419.521 g/mol
SMILES N(C(COc1ccc(C23C[C@]4(C[C@](C[C@@](C3)(C4)[H])(C2)[H])[H])cc1)=O)Cc1ccc2c(c1)OCO2
SPLASH splash10-0006-1900100000-d9443831bc23e1f2391b
Source of Spectrum IY-2-4985-1
Wiley ID 1657834