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4-Methylthiobenzylformiate
SpectraBase Compound ID 8XGYTfv2xlA
InChI InChI=1S/C9H10O2S/c1-12-9-4-2-8(3-5-9)6-11-7-10/h2-5,7H,6H2,1H3
InChIKey NLRMSUMLCFTXJU-UHFFFAOYSA-N
Mol Weight 182.24 g/mol
Molecular Formula C9H10O2S
Exact Mass 182.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFaokwnpUO0
Name 4-Methylthiobenzylformiate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 182.040150734 u
Formula C9H10O2S
InChI InChI=1S/C9H10O2S/c1-12-9-4-2-8(3-5-9)6-11-7-10/h2-5,7H,6H2,1H3
InChIKey NLRMSUMLCFTXJU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 182.237 g/mol
Nominal Mass 182 u
Quality 989
Retention Index 1486
SMILES C1(=CC=C(C=C1)SC)COC=O
SPLASH splash10-000i-6900000000-fd5c7e7ca17b41bef8b8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-methylthiobenzyl formate
Technique GC/MS
Wiley ID DD2024_004508