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6,6-Dimethyl-3-nitro-8,9-dihydro-7H-benzocyclohepten-5-one
SpectraBase Compound ID 8Rn6BmVR27o
InChI InChI=1S/C13H15NO3/c1-13(2)7-3-4-9-5-6-10(14(16)17)8-11(9)12(13)15/h5-6,8H,3-4,7H2,1-2H3
InChIKey ZJPXGKVQUYZBBL-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hFWj6pnYgc
Name 6,6-Dimethyl-3-nitro-8,9-dihydro-7H-benzocyclohepten-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-13(2)7-3-4-9-5-6-10(14(16)17)8-11(9)12(13)15/h5-6,8H,3-4,7H2,1-2H3
InChIKey ZJPXGKVQUYZBBL-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES c1(N(=O)=O)cc2C(C(CCCc2cc1)(C)C)=O
SPLASH splash10-014i-9010000000-5fb379c6fe114f200240
Source of Spectrum J-59-8301-3
Synonyms 6,6-Dimethyl-3-nitro-8,9-dihydro-7H-benzo[7]annulen-5-one
Wiley ID 1234934