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2exo,3exo,5exo,6exo-Tetradeuterio-1,2endo-trimethylenenorbornane
SpectraBase Compound ID 90Ia2RH2Qka
InChI InChI=1S/C10H16/c1-2-9-6-8-3-5-10(9,4-1)7-8/h8-9H,1-7H2/t8-,9-,10-/m0/s1/i3D,5D,6D,9D/t3-,5+,6-,8+,9+,10+/m1
InChIKey BWRRUOFLSXVDGW-NXAQKLNKSA-N
Mol Weight 140.26 g/mol
Molecular Formula C10H122D4
Exact Mass 140.150307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lU1BuLUyFv
Name 2exo,3exo,5exo,6exo-Tetradeuterio-1,2endo-trimethylenenorbornane
Alternate Name(s) (3aS,4S,5R,6R,7R,7aS)-octahydro-3a,6-methanoindene-4,5,7,7a-d4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12D4
InChI InChI=1S/C10H16/c1-2-9-6-8-3-5-10(9,4-1)7-8/h8-9H,1-7H2/t8-,9-,10-/m0/s1/i3D,5D,6D,9D/t3-,5+,6-,8+,9+,10+/m1
InChIKey BWRRUOFLSXVDGW-NXAQKLNKSA-N
Literature Reference DOI 10.1002/hlca.19800630414
Molecular Weight 140.262 g/mol
SMILES [C@@]1([C@]23C[C@@]([C@@]1([2D])[H])([C@]([C@@]3(CCC2)[2D])([2D])[H])[H])([2D])[H]
SPLASH splash10-053s-9400000000-614bacdc76d50f5840c1
Source of Spectrum H-63-871-9
Wiley ID 1797458