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12,12,13,13,15,5,16,16-Octadeuterio-heptadecane-1-carboxylic acid

View entire compound with spectra: 1 MS (GC)

12,12,13,13,15,5,16,16-Octadeuterio-heptadecane-1-carboxylic acid
SpectraBase Compound ID IBg7lQVew6o
InChI InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)/i2D2,3D,5D2,6D2,13D
InChIKey QIQXTHQIDYTFRH-OAYYCGBXSA-N
Mol Weight 292.53 g/mol
Molecular Formula C18H282D8O2
Exact Mass 292.321744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEQEtlPVS7N
Name 12,12,13,13,15,5,16,16-Octadeuterio-heptadecane-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28D8O2
InChI InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)/i2D2,3D,5D2,6D2,13D
InChIKey QIQXTHQIDYTFRH-OAYYCGBXSA-N
Molecular Weight 292.533 g/mol
SMILES OC(CCCCC(CCCCCCC(C(CC(C(C)([2D])[2D])[2D])([2D])[2D])([2D])[2D])[2D])=O
SPLASH splash10-03l0-9030000000-aecf017f15b81e320c55
Source of Spectrum U-1994-139-42
Wiley ID 765752