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(+-)-(1R*,4S*,5R*,6S*)-2-[(Z)-Hept-1'-enyl]-3-(hydroxymethyl)-5,6-epoxycyclohex-2-ene-1,4-diol
SpectraBase Compound ID 1PNBiqSZ5Ui
InChI InChI=1S/C14H22O4/c1-2-3-4-5-6-7-9-10(8-15)12(17)14-13(18-14)11(9)16/h6-7,11-17H,2-5,8H2,1H3/b7-6-/t11-,12+,13-,14+/m1/s1
InChIKey CBWMFTMZESYHBT-CZWCDEETSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65PLIDpr5t3
Name (+-)-(1R*,4S*,5R*,6S*)-2-[(Z)-Hept-1'-enyl]-3-(hydroxymethyl)-5,6-epoxycyclohex-2-ene-1,4-diol
Alternate Name(s) (+-)-Z isomer of Eupenoxide (1R,2R,5S,6S)-3-[(1Z)-1-heptenyl]-4-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
CAS Registry Number 89826-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-2-3-4-5-6-7-9-10(8-15)12(17)14-13(18-14)11(9)16/h6-7,11-17H,2-5,8H2,1H3/b7-6-/t11-,12+,13-,14+/m1/s1
InChIKey CBWMFTMZESYHBT-CZWCDEETSA-N
Molecular Weight 254.326 g/mol
SMILES O[C@@]1(C(=C([C@@]([C@]2([C@@]1(O2)[H])[H])(O)[H])CO)\C=C/CCCCC)[H]
SPLASH splash10-0aym-1910000000-8474700caa55f781a49f
Source of Spectrum J-49-1904-0
Wiley ID 1257666