John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BVwRAMOBhFx SpectraBase Spectrum ID=10dmmUjCVpz

(accessed ).
6-benzylidene-1,2,3,4,4a,6,7,8,9,9a-decahydro-3-nitro-5H-benzocyclohepten-5-one
SpectraBase Compound ID BVwRAMOBhFx
InChI InChI=1S/C18H15NO3/c20-18-15(11-13-5-2-1-3-6-13)8-4-7-14-9-10-16(19(21)22)12-17(14)18/h1-3,5-6,9-12H,4,7-8H2
InChIKey PPHJGFKIIJSSFT-UHFFFAOYSA-N
Mol Weight 293.32 g/mol
Molecular Formula C18H15NO3
Exact Mass 293.105193 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 10dmmUjCVpz
Name 6-BENZYLIDENE-3-NITRO-6,7,8,9-TETRAHYDRO-5H-BENZOCYCLOHEPTEN-5-ONE
Source of Sample A. G. Hammam, National Research Centre, Dokki, Cairo, Egypt
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Formula C18H15NO3
InChI InChI=1S/C18H15NO3/c20-18-15(11-13-5-2-1-3-6-13)8-4-7-14-9-10-16(19(21)22)12-17(14)18/h1-3,5-6,9-12H,4,7-8H2
InChIKey PPHJGFKIIJSSFT-UHFFFAOYSA-N
Literature Reference J. CHEM. ENG. DATA 23, 91(1978) Abstract-Chemical Abstracts= 88, 105261(1978)
Melting Point 155C
Molecular Weight 293.321991
SpectraBase Batch ID H9YoUPr7Yy2
Synonyms 5H-BENZOCYCLOHEPTEN-5-ONE, 6-BENZYL- IDENE-3-NITRO-6,7,8,9-TETRAHYDRO-,
Technique KBr WAFER