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ADB-BUTINACA-D9
SpectraBase Compound ID 8ervwn495Kp
InChI InChI=1S/C18H26N4O2/c1-5-6-11-22-13-10-8-7-9-12(13)14(21-22)17(24)20-15(16(19)23)18(2,3)4/h7-10,15H,5-6,11H2,1-4H3,(H2,19,23)(H,20,24)/t15-/m1/s1/i1D3,5D2,6D2,11D2
InChIKey GPWADXHYJAZPAX-PWGYCJDCSA-N
Mol Weight 339.49 g/mol
Molecular Formula C18H17D9N4O2
Exact Mass 339.262067 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UuwixWJCS
Name ADB-BUTINACA-D9
Catalog Number 35896
Lot Number 697573
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.262066804 u
Formula C18H17D9N4O2
InChI InChI=1S/C18H26N4O2/c1-5-6-11-22-13-10-8-7-9-12(13)14(21-22)17(24)20-15(16(19)23)18(2,3)4/h7-10,15H,5-6,11H2,1-4H3,(H2,19,23)(H,20,24)/t15-/m1/s1/i1D3,5D2,6D2,11D2
InChIKey GPWADXHYJAZPAX-PWGYCJDCSA-N
Molecular Weight 339.487 g/mol
Quality 1000
SMILES N(C(C1=NN(C=2C=CC=CC12)C(C(C(C([D])([D])[D])([D])[D])([D])[D])([D])[D])=O)[C@](C(N)=O)(C(C)(C)C)[H]
SPLASH splash10-03dj-2390000000-74184ee882c55780a1b9
Source of Spectrum CAY-2024-2371-0
Synonyms 2-({1-[(1,1,2,2,3,3,4,4,4-2H9)butyl]-1H-indazol-3-yl}formamido)-3,3-dimethylbutanamide
Wiley ID 1890580