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7,8-Diethyl-3-azatetracyclo[5.2.1.1(5,8).0(1,5)]undecane (2R,3R)-Tartrate
SpectraBase Compound ID 5bqn2oinilo
InChI InChI=1S/C14H23N.C4H6O6/c1-3-11-5-13-7-12(11,4-2)8-14(13,6-11)10-15-9-13;5-1(3(7)8)2(6)4(9)10/h15H,3-10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t11?,12?,13-,14+;1-,2-/m.1/s1
InChIKey PHOHXNGTDPMTFB-SBXILKGOSA-N
Mol Weight 355.43 g/mol
Molecular Formula C18H29NO6
Exact Mass 355.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkZM7MT0d14
Name 7,8-Diethyl-3-azatetracyclo[5.2.1.1(5,8).0(1,5)]undecane (2R,3R)-Tartrate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO6
InChI InChI=1S/C14H23N.C4H6O6/c1-3-11-5-13-7-12(11,4-2)8-14(13,6-11)10-15-9-13;5-1(3(7)8)2(6)4(9)10/h15H,3-10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t11?,12?,13-,14+;1-,2-/m.1/s1
InChIKey PHOHXNGTDPMTFB-SBXILKGOSA-N
Instrument Name Agilent 5975 GC-122-5532 DB-5MS
Ionization Type EI
Literature Reference DOI 10.1021/jm401340p
Molecular Weight 355.431 g/mol
SMILES N1C[C@]23[C@]4(C1)CC(C(C3)(C4)CC)(C2)CC.OC([C@@]([C@](C(O)=O)(O)[H])(O)[H])=O
SPLASH splash10-03di-1900000000-c5b4e7365da2735ed582
Source of Spectrum AF-56-9272-14c??(2R,3R)-Tartrate
Wiley ID 1865437