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3-Benzyl-2-benzyloxycarbonyl)-6-isopropoxy-1-oxa-2,5-diaza-4-oxocyclohexane
SpectraBase Compound ID 9g5V6G5ESYM
InChI InChI=1S/C21H24N2O5/c1-15(2)27-20-22-19(24)18(13-16-9-5-3-6-10-16)23(28-20)21(25)26-14-17-11-7-4-8-12-17/h3-12,15,18,20H,13-14H2,1-2H3,(H,22,24)
InChIKey YWCOZTDEXQSXCK-UHFFFAOYSA-N
Mol Weight 384.43 g/mol
Molecular Formula C21H24N2O5
Exact Mass 384.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GWWN1bRY0n
Name 3-Benzyl-2-benzyloxycarbonyl)-6-isopropoxy-1-oxa-2,5-diaza-4-oxocyclohexane
Comments Less than 3 mono-isotopic peaks
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Formula C21H24N2O5
InChI InChI=1S/C21H24N2O5/c1-15(2)27-20-22-19(24)18(13-16-9-5-3-6-10-16)23(28-20)21(25)26-14-17-11-7-4-8-12-17/h3-12,15,18,20H,13-14H2,1-2H3,(H,22,24)
InChIKey YWCOZTDEXQSXCK-UHFFFAOYSA-N
Molecular Weight 384.432 g/mol
SMILES N1C(C(N(OC1OC(C)C)C(OCc1ccccc1)=O)Cc1ccccc1)=O
SPLASH splash10-0006-9000000000-dd131168859137393880
Source of Spectrum F-52-7576-4
Synonyms benzyl 3-benzyl-6-isopropoxy-4-oxotetrahydro-2H-1,2,5-oxadiazine-2-carboxylate
Wiley ID 796795