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(2S,7E,9E)-12-(1,3-benzodioxol-5-yl)-2-dodeca-7,9-dienol
SpectraBase Compound ID 76EtZQLWKZ5
InChI InChI=1S/C19H26O3/c1-16(20)10-8-6-4-2-3-5-7-9-11-17-12-13-18-19(14-17)22-15-21-18/h2-3,5,7,12-14,16,20H,4,6,8-11,15H2,1H3/b3-2+,7-5+/t16-/m0/s1
InChIKey SGILAVRZPYCFMT-IONKVUFISA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Xnmt0nRCua
Name (2S,7E,9E)-12-(1,3-benzodioxol-5-yl)-2-dodeca-7,9-dienol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-16(20)10-8-6-4-2-3-5-7-9-11-17-12-13-18-19(14-17)22-15-21-18/h2-3,5,7,12-14,16,20H,4,6,8-11,15H2,1H3/b3-2+,7-5+/t16-/m0/s1
InChIKey SGILAVRZPYCFMT-IONKVUFISA-N
Molecular Weight 302.414 g/mol
SMILES O[C@](CCCC\C=C\C=C\CCc1cc2c(OCO2)cc1)(C)[H]
SPLASH splash10-000i-1900000000-015df702313b4ffd9692
Source of Spectrum J-58-7806-1
Synonyms (2S,7E,9E)-12-(1,3-benzodioxol-5-yl)dodeca-7,9-dien-2-ol
Wiley ID 1305003