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2-Heptadec-8-enyl-5-nitro-1,3-benzoxazole
SpectraBase Compound ID CqFLCw9HStJ
InChI InChI=1S/C24H36N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-25-22-20-21(26(27)28)18-19-23(22)29-24/h9-10,18-20H,2-8,11-17H2,1H3
InChIKey MPYKOHBEFOKSNF-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C24H36N2O3
Exact Mass 400.272593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IsnnTY4w4
Name 2-Heptadec-8-enyl-5-nitro-1,3-benzoxazole
Alternate Name(s) 2-(heptadec-8-en-1-yl)-5-nitrobenzo[d]oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36N2O3
InChI InChI=1S/C24H36N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-25-22-20-21(26(27)28)18-19-23(22)29-24/h9-10,18-20H,2-8,11-17H2,1H3
InChIKey MPYKOHBEFOKSNF-UHFFFAOYSA-N
Molecular Weight 400.563 g/mol
SMILES c1(cc2c(cc1)oc(n2)CCCCCCCC=CCCCCCCCC)[N+]([O-])=O
SPLASH splash10-005c-0961000000-1ad38caddd360ea470ac
Source of Spectrum SI-6-33-5
Wiley ID 1813427