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.alpha.-dideuterobenzylamino-.omega.-benzyloxyheptane
SpectraBase Compound ID BXSBNPkSMvt
InChI InChI=1S/C21H29NO/c1(2-10-16-22-18-20-12-6-4-7-13-20)3-11-17-23-19-21-14-8-5-9-15-21/h4-9,12-15,22H,1-3,10-11,16-19H2/i18D2
InChIKey ORVYCVRRQZFCTN-CPLZMPMBSA-N
Mol Weight 313.48 g/mol
Molecular Formula C21H272D2NO
Exact Mass 313.237468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTIYbolQ2lE
Name .alpha.-dideuterobenzylamino-.omega.-benzyloxyheptane
Alternate Name(s) 1.alpha.-dideuterobenzylamino-7-benzyloxyheptane
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Formula C21H27D2NO
InChI InChI=1S/C21H29NO/c1(2-10-16-22-18-20-12-6-4-7-13-20)3-11-17-23-19-21-14-8-5-9-15-21/h4-9,12-15,22H,1-3,10-11,16-19H2/i18D2
InChIKey ORVYCVRRQZFCTN-CPLZMPMBSA-N
Molecular Weight 313.481 g/mol
SMILES N(C(c1ccccc1)([2D])[2D])CCCCCCCOCc1ccccc1
SPLASH splash10-00dl-8920000000-5079231e675e942e794a
Source of Spectrum B2-33-2-0
Wiley ID 1312722