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5-Nonenoic-5,6-D2 acid, methyl ester
SpectraBase Compound ID 6IfLpDWEnRx
InChI InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-10(11)12-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+/i5D,6D
InChIKey NXPOJJCVLXVOLL-LHXUNJIASA-N
Mol Weight 172.26 g/mol
Molecular Formula C10H16D2O2
Exact Mass 172.143233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IL2LMTU4NOK
Name 5-Nonenoic-5,6-D2 acid, methyl ester
Alternate Name(s) Methyl 5,6 dideutero-5-nonenoate
CAS Registry Number 20824-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16D2O2
InChI InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-10(11)12-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+/i5D,6D
InChIKey NXPOJJCVLXVOLL-LHXUNJIASA-N
Molecular Weight 172.264 g/mol
SMILES C(=O)(OC)CCC\C(=C\(CCC)[D])[D]
SPLASH splash10-0597-9000000000-f5ea8017b8f186cbca7d
Source of Spectrum EP-4792-0-0
Wiley ID 1167322