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3-Spiro-2',2',6',6'-tetradeuterocyclohexane-3H-indole-2-carboxanilide
SpectraBase Compound ID 2qzagBm7Wk0
InChI InChI=1S/C20H20N2O/c23-19(21-15-9-3-1-4-10-15)18-20(13-7-2-8-14-20)16-11-5-6-12-17(16)22-18/h1,3-6,9-12H,2,7-8,13-14H2,(H,21,23)/i13D2,14D2
InChIKey MBSUDRREFLJRIU-RYIWKTDQSA-N
Mol Weight 308.42 g/mol
Molecular Formula C20H162D4N2O
Exact Mass 308.18267 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyhyEeedL5e
Name 3-Spiro-2',2',6',6'-tetradeuterocyclohexane-3H-indole-2-carboxanilide
CAS Registry Number 18392-05-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16D4N2O
InChI InChI=1S/C20H20N2O/c23-19(21-15-9-3-1-4-10-15)18-20(13-7-2-8-14-20)16-11-5-6-12-17(16)22-18/h1,3-6,9-12H,2,7-8,13-14H2,(H,21,23)/i13D2,14D2
InChIKey MBSUDRREFLJRIU-RYIWKTDQSA-N
Molecular Weight 308.417 g/mol
SMILES N(C(C1=Nc2c(cccc2)C11C(CCCC1([2D])[2D])([2D])[2D])=O)c1ccccc1
SPLASH splash10-0a4r-0936000000-e0adfd857ef0e4c0d137
Source of Spectrum AD-0-1277-0
Wiley ID 45297