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2-Henicosa-3,6,9,12,15,18-hexaenyl-1,3-benzoxazole
SpectraBase Compound ID YslDiu2yrs
InChI InChI=1S/C28H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-29-26-23-21-22-24-27(26)30-28/h3-4,6-7,9-10,12-13,15-16,18-19,21-24H,2,5,8,11,14,17,20,25H2,1H3
InChIKey WKZJDLBYCPDXOT-UHFFFAOYSA-N
Mol Weight 401.6 g/mol
Molecular Formula C28H35NO
Exact Mass 401.271865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0g3kksMzAx
Name 2-Henicosa-3,6,9,12,15,18-hexaenyl-1,3-benzoxazole
Alternate Name(s) 2-(henicosa-3,6,9,12,15,18-hexaen-1-yl)benzo[d]oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H35NO
InChI InChI=1S/C28H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-29-26-23-21-22-24-27(26)30-28/h3-4,6-7,9-10,12-13,15-16,18-19,21-24H,2,5,8,11,14,17,20,25H2,1H3
InChIKey WKZJDLBYCPDXOT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.3071
Molecular Weight 401.594 g/mol
SMILES C(C=CCC=CCC=CCC=CCC=CCCc1nc2c(o1)cccc2)C=CCC
SPLASH splash10-001i-3910000000-f19aa1a3e98b700c7e3d
Source of Spectrum RCM-21-2135-Fig7(C)
Wiley ID 1820584