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1,1,1,2,2-Pentadeutero-trans,trans-4,6-nonadien-8-yn-3-ol
SpectraBase Compound ID AmgmznraxvR
InChI InChI=1S/C9H12O/c1-3-5-6-7-8-9(10)4-2/h1,5-10H,4H2,2H3/b6-5+,8-7+/i2D3,4D2
InChIKey MHDGOQSLUCTWIS-STWOANKNSA-N
Mol Weight 141.22 g/mol
Molecular Formula C9H7D5O
Exact Mass 141.120199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AxAnOJi49ub
Name 1,1,1,2,2-Pentadeutero-trans,trans-4,6-nonadien-8-yn-3-ol
CAS Registry Number 56248-30-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7D5O
InChI InChI=1S/C9H12O/c1-3-5-6-7-8-9(10)4-2/h1,5-10H,4H2,2H3/b6-5+,8-7+/i2D3,4D2
InChIKey MHDGOQSLUCTWIS-STWOANKNSA-N
Molecular Weight 141.225 g/mol
SMILES OC(\C=C\C=C\C#C)C(C([D])([D])[D])([D])[D]
SPLASH splash10-03fr-9200000000-2b416a3dbaaad5476fdd
Source of Spectrum F-29-1737-3
Wiley ID 1136401