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Quinoline-2,5-D2, 1-acetyldecahydro-2-d-7-methyl-
SpectraBase Compound ID 4VqYPC30DNc
InChI InChI=1S/C12H21NO/c1-9-5-6-11-4-3-7-13(10(2)14)12(11)8-9/h9,11-12H,3-8H2,1-2H3/t9?,11-,12-/m0/s1/i6D,7D2/t6?,9?,11-,12-
InChIKey BRPCIRQPIXDEIX-UBAWVNIDSA-N
Mol Weight 198.32 g/mol
Molecular Formula C12H182D3NO
Exact Mass 198.181145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Hp8ntXhy3W
Name Quinoline-2,5-D2, 1-acetyldecahydro-2-d-7-methyl-
CAS Registry Number 80154-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18D3NO
InChI InChI=1S/C12H21NO/c1-9-5-6-11-4-3-7-13(10(2)14)12(11)8-9/h9,11-12H,3-8H2,1-2H3/t9?,11-,12-/m0/s1/i6D,7D2/t6?,9?,11-,12-
InChIKey BRPCIRQPIXDEIX-UBAWVNIDSA-N
Molecular Weight 198.324 g/mol
SMILES [C@]12(N(C(CC[C@]1(C(CC(C2)C)[2D])[H])([2D])[2D])C(=O)C)[H]
SPLASH splash10-0002-9800000000-99e70606ea2afff7db8e
Source of Spectrum I-59-2701-0
Synonyms 2,2,5-Trideuterio-trans-N-acetyl-7-methyldecahydroquinoline
Wiley ID 91254