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syn-6a,14.beta.-Dideutero-5,6,6a,7,13,13a-hexahydro-7,13-methanoquino[3,4-c][1]benzazepine
SpectraBase Compound ID KrvJw8KqcdQ
InChI InChI=1S/C18H18N2/c1-4-8-16-11(5-1)13-9-17(20-16)14-10-19-15-7-3-2-6-12(15)18(13)14/h1-8,13-14,17-20H,9-10H2/t13-,14?,17-,18?/m1/s1/i9D,14D/t9-,13+,14?,17+,18?/m0
InChIKey CZKDOPWBRQDQQF-GXAPONNBSA-N
Mol Weight 264.37 g/mol
Molecular Formula C18H162D2N2
Exact Mass 264.159552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfbhXirIM0m
Name syn-6a,14.beta.-Dideutero-5,6,6a,7,13,13a-hexahydro-7,13-methanoquino[3,4-c][1]benzazepine
Comments Less than 3 mono-isotopic peaks
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Formula C18H16D2N2
InChI InChI=1S/C18H18N2/c1-4-8-16-11(5-1)13-9-17(20-16)14-10-19-15-7-3-2-6-12(15)18(13)14/h1-8,13-14,17-20H,9-10H2/t13-,14?,17-,18?/m1/s1/i9D,14D/t9-,13+,14?,17+,18?/m0
InChIKey CZKDOPWBRQDQQF-GXAPONNBSA-N
Molecular Weight 264.368 g/mol
SMILES N1CC2([C@]3([C@]([C@@](C2c2c1cccc2)(c1c(cccc1)N3)[H])([2D])[H])[H])[2D]
SPLASH splash10-001i-0910000000-6beaa4b0372ecd3cd744
Source of Spectrum J-67-4701-2
Wiley ID 1570242