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METHYL 4-HYDROXYMETHYL-3-THIOPHENE
SpectraBase Compound ID K1jD4ePp8X5
InChI InChI=1S/C7H8O3S/c1-10-7(9)6-4-11-3-5(6)2-8/h3-4,8H,2H2,1H3
InChIKey GMFPPVRGDDNSAF-UHFFFAOYSA-N
Mol Weight 172.2 g/mol
Molecular Formula C7H8O3S
Exact Mass 172.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjjvT20SszM
Name METHYL 4-HYDROXYMETHYL-3-THIOPHENE
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 172.019415289 u
Formula C7H8O3S
InChI InChI=1S/C7H8O3S/c1-10-7(9)6-4-11-3-5(6)2-8/h3-4,8H,2H2,1H3
InChIKey GMFPPVRGDDNSAF-UHFFFAOYSA-N
Molecular Weight 172.198 g/mol
Nominal Mass 172 u
Number of Peaks 71
SMILES OCc1cscc1C(OC)=O
SPLASH splash10-000l-4900000000-4a8df90c9e9fe0f618b8
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000993