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4,6-Octadiene-1,3-diol, 2,2-dimethyl-, [S-(E,Z)]-
SpectraBase Compound ID 75tNKzw1lEs
InChI InChI=1S/C10H18O2/c1-4-5-6-7-9(12)10(2,3)8-11/h4-7,9,11-12H,8H2,1-3H3/b5-4-,7-6+/t9-/m0/s1
InChIKey VMYFNOZUIREUKA-GMNTXOCVSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sQounGvBqQ
Name 4,6-Octadiene-1,3-diol, 2,2-dimethyl-, [S-(E,Z)]-
Alternate Name(s) (3S,4E,6Z)-2,2-dimethyl-4,6-octadiene-1,3-diol
CAS Registry Number 39824-01-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-4-5-6-7-9(12)10(2,3)8-11/h4-7,9,11-12H,8H2,1-3H3/b5-4-,7-6+/t9-/m0/s1
InChIKey VMYFNOZUIREUKA-GMNTXOCVSA-N
Molecular Weight 170.252 g/mol
SMILES O[C@](C(CO)(C)C)(\C=C\C=C/C)[H]
SPLASH splash10-0002-9000000000-854ee0f95ee7019359e0
Source of Spectrum I-58-519-0
Wiley ID 1166900