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2-Octenoic acid, 8-hydroxy-3,7-dimethyl-, methyl ester, [S-(E)]-
SpectraBase Compound ID B0Rw9w48HrC
InChI InChI=1S/C11H20O3/c1-9(7-11(13)14-3)5-4-6-10(2)8-12/h7,10,12H,4-6,8H2,1-3H3/b9-7+/t10-/m0/s1
InChIKey ZTBVAKKRVNVTCS-PCYYEKQGSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1IL0TBe4oG
Name 2-Octenoic acid, 8-hydroxy-3,7-dimethyl-, methyl ester, [S-(E)]-
Alternate Name(s) Methyl (2E,7S)-8-hydroxy-3,7-dimethyl-2-octenoate Methyl (E)-(S)-(+)-3,7-dimethyl-8-hydroxy-oct-2-enoate Methyl (E)-(S)-(-)-3,7-dimethyl-8-hydroxy-2-octenoate
CAS Registry Number 104210-71-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-9(7-11(13)14-3)5-4-6-10(2)8-12/h7,10,12H,4-6,8H2,1-3H3/b9-7+/t10-/m0/s1
InChIKey ZTBVAKKRVNVTCS-PCYYEKQGSA-N
Molecular Weight 200.278 g/mol
SMILES OC[C@](CCC\C(=C\C(=O)OC)C)(C)[H]
SPLASH splash10-0a5c-9100000000-96b11d9e8020c609b492
Source of Spectrum F-43-4484-9
Wiley ID 1197724