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Azulene, 1,4-dimethyl-7-(1-methylethyl)-3-(2-nitroethenyl)-, (E)-
SpectraBase Compound ID 7pZNXrLVjG5
InChI InChI=1S/C17H19NO2/c1-11(2)14-6-5-12(3)17-15(7-8-18(19)20)9-13(4)16(17)10-14/h5-11H,1-4H3/b8-7+
InChIKey KWVHAVHMCGMCGT-BQYQJAHWSA-N
Mol Weight 269.34 g/mol
Molecular Formula C17H19NO2
Exact Mass 269.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNMGQ3OKd0v
Name Azulene, 1,4-dimethyl-7-(1-methylethyl)-3-(2-nitroethenyl)-, (E)-
Alternate Name(s) 1,4-Dimethyl-3-[(E)-2-nitroethenyl]-7-propan-2-ylazulene 1,4-Dimethyl-3-[(E)-2-nitroethenyl]-7-propan-2-yl-azulene
CAS Registry Number 96995-26-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO2
InChI InChI=1S/C17H19NO2/c1-11(2)14-6-5-12(3)17-15(7-8-18(19)20)9-13(4)16(17)10-14/h5-11H,1-4H3/b8-7+
InChIKey KWVHAVHMCGMCGT-BQYQJAHWSA-N
Molecular Weight 269.344 g/mol
SMILES c12c(c(\C=C\N(=O)=O)cc2C)c(ccc(c1)C(C)C)C
SPLASH splash10-044i-0090000000-be0c9ffe86a74e6d84e6
Source of Spectrum AJ-58-371-10
Wiley ID 1273406