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(R)-(-)-Mellein
SpectraBase Compound ID 1bhJ7Ua4IFf
InChI InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3
InChIKey KWILGNNWGSNMPA-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Frz4JJZE6qz
Name (R)-(-)-Mellein
Source of Sample Cayman Chemical Company
Catalog Number 10311
Lot Number 0606014-10
Accessory DurasamplIR II
CAS Registry Number 480-33-1
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.062994179 u
Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3
InChIKey KWILGNNWGSNMPA-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 178.187 g/mol
Purity ≥98%
Resolution 4
SMILES C1(CC=2C(C(O1)=O)=C(C=CC2)O)C
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 3,4-dihydro-8-hydroxy-3-methyl-1H-2-benzopyran-1-one Ochracin
Technique ATR-Neat