SpectraBase Compound ID | 1GNZzA0WW1G |
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InChI | InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3/i4D |
InChIKey | IQYJSKNHDZZDGA-QYKNYGDISA-N |
Mol Weight | 137.16 g/mol |
Molecular Formula | C8H72HO2 |
Exact Mass | 137.058706 g/mol |
SpectraBase Spectrum ID | 2aW7oYcImqu |
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Name | 2-Methoxy(4-D)cyclohepta-2,4,6-trien-1-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H7DO2 |
InChI | InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3/i4D |
InChIKey | IQYJSKNHDZZDGA-QYKNYGDISA-N |
Molecular Weight | 137.156 g/mol |
SMILES | C1=C(C(C=CC=C1[D])=O)OC |
SPLASH | splash10-0a4i-0900000000-6945167af3e4774ca1b8 |
Source of Spectrum | B-50-405-26 |
Synonyms | 2-Methoxy-4-deuteriocyclohepta-2,4,6-trien-1-one |
Wiley ID | 745550 |