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2,4-Bisallyl-5-n-pendecylbenzene-1,3-diol

View entire compound with spectra: 2 MS (GC)

2,4-Bisallyl-5-n-pendecylbenzene-1,3-diol
SpectraBase Compound ID AOOywev6G1Z
InChI InChI=1S/C27H44O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-21-23-22-26(28)25(20-6-3)27(29)24(23)19-5-2/h5-6,22,28-29H,2-4,7-21H2,1H3
InChIKey NSIUOHOHIYCBGN-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C27H44O2
Exact Mass 400.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaStDvcoAVK
Name 2,4-Bisallyl-5-n-pendecylbenzene-1,3-diol
Alternate Name(s) 2,4-Bisallyl-5-n-pentadecylbenzene-1,3-diol 2,4-Diallyl-5-n-pentadecylbenzene-1,3-diol 2,4-Diallyl-5-pentadecyl-1,3-benzenediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O2
InChI InChI=1S/C27H44O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-21-23-22-26(28)25(20-6-3)27(29)24(23)19-5-2/h5-6,22,28-29H,2-4,7-21H2,1H3
InChIKey NSIUOHOHIYCBGN-UHFFFAOYSA-N
Molecular Weight 400.647 g/mol
SMILES Oc1c(c(c(c(c1)CCCCCCCCCCCCCCC)CC=C)O)CC=C
SPLASH splash10-03di-0910000000-738e7d60559d2cfa2881
Source of Spectrum SO-0-2755-21
Wiley ID 864687