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2,2,6-Trimethyl-1-[(1E,3E,5E,7E)-2',6'-dimethyl-1'-nitro-1',3',5',7'-octatetraen-8'-yl]-7-oxabicyclo[4.1.0]heptane
SpectraBase Compound ID DEQuHMUAe9C
InChI InChI=1S/C19H27NO3/c1-15(8-6-9-16(2)14-20(21)22)10-13-19-17(3,4)11-7-12-18(19,5)23-19/h6,8-10,13-14H,7,11-12H2,1-5H3/b9-6+,13-10+,15-8+,16-14+
InChIKey ALVVZSFTKLPFBT-WEDZBJJJSA-N
Mol Weight 317.43 g/mol
Molecular Formula C19H27NO3
Exact Mass 317.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YjJGAHSy5e
Name 2,2,6-Trimethyl-1-[(1E,3E,5E,7E)-2',6'-dimethyl-1'-nitro-1',3',5',7'-octatetraen-8'-yl]-7-oxabicyclo[4.1.0]heptane
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Formula C19H27NO3
InChI InChI=1S/C19H27NO3/c1-15(8-6-9-16(2)14-20(21)22)10-13-19-17(3,4)11-7-12-18(19,5)23-19/h6,8-10,13-14H,7,11-12H2,1-5H3/b9-6+,13-10+,15-8+,16-14+
InChIKey ALVVZSFTKLPFBT-WEDZBJJJSA-N
Molecular Weight 317.429 g/mol
SMILES C12(OC2(CCCC1(C)C)C)\C=C\C(=C\C=C\C(=C\N(=O)=O)C)C
SPLASH splash10-0gi0-0049000000-2451dc55beb0be837608
Source of Spectrum CRT-16-504-5a
Wiley ID 1710014