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5-[(Z)-7-benzoxyhept-1-enyl]-1,3-benzodioxole
SpectraBase Compound ID IqpZ3Lx8xTo
InChI InChI=1S/C21H24O3/c1(3-8-14-22-16-19-10-6-4-7-11-19)2-5-9-18-12-13-20-21(15-18)24-17-23-20/h4-7,9-13,15H,1-3,8,14,16-17H2/b9-5-
InChIKey TZABWNRKTAAUBT-UITAMQMPSA-N
Mol Weight 324.42 g/mol
Molecular Formula C21H24O3
Exact Mass 324.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KNGTcKr4Gu
Name 5-[(Z)-7-benzoxyhept-1-enyl]-1,3-benzodioxole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O3
InChI InChI=1S/C21H24O3/c1(3-8-14-22-16-19-10-6-4-7-11-19)2-5-9-18-12-13-20-21(15-18)24-17-23-20/h4-7,9-13,15H,1-3,8,14,16-17H2/b9-5-
InChIKey TZABWNRKTAAUBT-UITAMQMPSA-N
Molecular Weight 324.420 g/mol
SMILES c12c(OCO2)ccc(\C=C/CCCCCOCc2ccccc2)c1
SPLASH splash10-000i-0903000000-c2fdf4435d6b08df08dc
Source of Spectrum E1-39-20-5
Synonyms 5-[(Z)-7-benzyloxyhept-1-enyl]-1,3-benzodioxole 5-[(Z)-7-phenylmethoxyhept-1-enyl]-1,3-benzodioxole
Wiley ID 1518672