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Bicyclo[2.2.1]heptane, 2-benzyl-3-deutero-
SpectraBase Compound ID 6z0IWkcNwec
InChI InChI=1S/C14H18/c1-2-4-11(5-3-1)8-14-10-12-6-7-13(14)9-12/h1-5,12-14H,6-10H2/t12-,13+,14+/m1/s1/i10D/t10-,12+,13-,14-/m0
InChIKey CBDBDKNQQUIABY-PYDJIOCISA-N
Mol Weight 187.3 g/mol
Molecular Formula C14H172D
Exact Mass 187.147127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Akmrbym7zSF
Name Bicyclo[2.2.1]heptane, 2-benzyl-3-deutero-
CAS Registry Number 61142-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17D
InChI InChI=1S/C14H18/c1-2-4-11(5-3-1)8-14-10-12-6-7-13(14)9-12/h1-5,12-14H,6-10H2/t12-,13+,14+/m1/s1/i10D/t10-,12+,13-,14-/m0
InChIKey CBDBDKNQQUIABY-PYDJIOCISA-N
Molecular Weight 187.304 g/mol
SMILES c1cccc(C[C@@]2([C@]3(CC[C@@]([C@@]2([2D])[H])(C3)[H])[H])[H])c1
SPLASH splash10-0002-9100000000-bab0be796ec27276e6c6
Source of Spectrum HE-1982-0-0
Synonyms 2-Benzylbicyclo[2.2.1]heptane-2-D Bicyclo[2.2.1]heptane-2-d, 3-(phenylmethyl)-
Wiley ID 1183514