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(3aR,7aR)-2,2-Dideuterio-1,3,3a,4,5,6,7,7a-octahydroindole
SpectraBase Compound ID AxKkyomkrhr
InChI InChI=1S/C8H15N/c1-2-4-8-7(3-1)5-6-9-8/h7-9H,1-6H2/t7-,8-/m1/s1/i6D2
InChIKey PDELQDSYLBLPQO-INCQCJHNSA-N
Mol Weight 127.23 g/mol
Molecular Formula C8H13D2N
Exact Mass 127.133003 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3z1Btm9rX5D
Name (3aR,7aR)-2,2-Dideuterio-1,3,3a,4,5,6,7,7a-octahydroindole
CAS Registry Number 117505-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13D2N
InChI InChI=1S/C8H15N/c1-2-4-8-7(3-1)5-6-9-8/h7-9H,1-6H2/t7-,8-/m1/s1/i6D2
InChIKey PDELQDSYLBLPQO-INCQCJHNSA-N
Molecular Weight 127.227 g/mol
SMILES N1C(C[C@@]2([C@]1(CCCC2)[H])[H])([D])[D]
SPLASH splash10-001i-9000000000-317091d2a287cf582901
Source of Spectrum Y-25-70-5
Wiley ID 1129505