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(E)-1-(1,3-benzodioxol-5-yl)-2-methoxy-2-buten-1-ol

View entire compound with spectra: 1 MS (GC)

(E)-1-(1,3-benzodioxol-5-yl)-2-methoxy-2-buten-1-ol
SpectraBase Compound ID K9IyD0XVFui
InChI InChI=1S/C12H14O4/c1-3-9(14-2)12(13)8-4-5-10-11(6-8)16-7-15-10/h3-6,12-13H,7H2,1-2H3/b9-3+
InChIKey NJBWGXLCXXMZER-YCRREMRBSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hiXOJJ0agc
Name (E)-1-(1,3-benzodioxol-5-yl)-2-methoxy-2-buten-1-ol
Alternate Name(s) (E)-1-(1,3-benzodioxol-5-yl)-2-methoxy-but-2-en-1-ol
CAS Registry Number 99309-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-3-9(14-2)12(13)8-4-5-10-11(6-8)16-7-15-10/h3-6,12-13H,7H2,1-2H3/b9-3+
InChIKey NJBWGXLCXXMZER-YCRREMRBSA-N
Molecular Weight 222.240 g/mol
SMILES OC(\C(=C/C)OC)c1cc2OCOc2cc1
SPLASH splash10-00r6-9210000000-171605b1c9cec6d0df6e
Source of Spectrum J-50-5312-5
Wiley ID 1222263