SpectraBase Compound ID | 85sMcToovJA |
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InChI | InChI=1S/C9H12O3/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,10-12H,4-5H2,1H3 |
InChIKey | KUMMBDBTERQYCG-UHFFFAOYSA-N |
Mol Weight | 168.19 g/mol |
Molecular Formula | C9H12O3 |
Exact Mass | 168.078644 g/mol |
SpectraBase Spectrum ID | J8L7yI0ibHw |
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Name | |
CAS Registry Number | 91-04-3 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C9H12O3 |
InChI | InChI=1S/C9H12O3/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,10-12H,4-5H2,1H3 |
InChIKey | KUMMBDBTERQYCG-UHFFFAOYSA-N |
Instrument Name | Bruker AM-270 |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | DMSO-D6 |