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N-[4-(Benzyloxy)-3-(hydroxymethyl)phenyl]-1,4-dioxaspiro[4.5]decane-6-carboxamide
SpectraBase Compound ID 3vbNo9bvwOo
InChI InChI=1S/C23H27NO5/c25-15-18-14-19(9-10-21(18)27-16-17-6-2-1-3-7-17)24-22(26)20-8-4-5-11-23(20)28-12-13-29-23/h1-3,6-7,9-10,14,20,25H,4-5,8,11-13,15-16H2,(H,24,26)
InChIKey JWKVOOUVJLTQDT-UHFFFAOYSA-N
Mol Weight 397.47 g/mol
Molecular Formula C23H27NO5
Exact Mass 397.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtvQWQ8K6Jp
Name N-[4-(Benzyloxy)-3-(hydroxymethyl)phenyl]-1,4-dioxaspiro[4.5]decane-6-carboxamide
Alternate Name(s) N-(4-benzoxy-3-methylol-phenyl)-1,4-dioxaspiro[4.5]decane-10-carboxamide N-[3-(hydroxymethyl)-4-phenylmethoxy-phenyl]-1,4-dioxaspiro[4.5]decane-10-carboxamide N-[4-benzyloxy-3-(hydroxymethyl)phenyl]-1,4-dioxaspiro[4.5]decane-10-carboxamide N-[3-(hydroxymethyl)-4-phenylmethoxyphenyl]-1,4-dioxaspiro[4.5]decane-6-carboxamide N-[4-benzyloxy-3-(hydroxymethyl)phenyl]-1,4-dioxaspiro[4.5]decane-6-carboxamide N-[3-(hydroxymethyl)-4-phenylmethoxy-phenyl]-1,4-dioxaspiro[4.5]decane-6-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C23H27NO5
InChI InChI=1S/C23H27NO5/c25-15-18-14-19(9-10-21(18)27-16-17-6-2-1-3-7-17)24-22(26)20-8-4-5-11-23(20)28-12-13-29-23/h1-3,6-7,9-10,14,20,25H,4-5,8,11-13,15-16H2,(H,24,26)
InChIKey JWKVOOUVJLTQDT-UHFFFAOYSA-N
Molecular Weight 397.471 g/mol
SMILES N(C(C1C2(OCCO2)CCCC1)=O)c1cc(CO)c(cc1)OCc1ccccc1
SPLASH splash10-014i-0900000000-aeff7fd43d266089e3ba
Source of Spectrum J-58-7583-7
Wiley ID 1368030