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N,O-diacetyl-N-pentyl-1,1-dideutero-3-amino-1-propanol
SpectraBase Compound ID 1zE33CGzl2K
InChI InChI=1S/C12H23NO3/c1-4-5-6-8-13(11(2)14)9-7-10-16-12(3)15/h4-10H2,1-3H3/i10D2
InChIKey KGAFPPHDKMMCFT-KBMKNGFXSA-N
Mol Weight 231.33 g/mol
Molecular Formula C12H212D2NO3
Exact Mass 231.180347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID md75I4oTCu
Name N,O-diacetyl-N-pentyl-1,1-dideutero-3-amino-1-propanol
CAS Registry Number 55191-05-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21D2NO3
InChI InChI=1S/C12H23NO3/c1-4-5-6-8-13(11(2)14)9-7-10-16-12(3)15/h4-10H2,1-3H3/i10D2
InChIKey KGAFPPHDKMMCFT-KBMKNGFXSA-N
Molecular Weight 231.332 g/mol
SMILES C(N(CCC(OC(=O)C)([2D])[2D])CCCCC)(=O)C
SPLASH splash10-0f89-1900000000-da20bee03a8b63748ef7
Source of Spectrum O-6-337-9
Wiley ID 30684