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Benzenemethanol, 2-[(3-hydroxypropyl)thio]-
SpectraBase Compound ID 49gbXB7R8WA
InChI InChI=1S/C10H14O2S/c11-6-3-7-13-10-5-2-1-4-9(10)8-12/h1-2,4-5,11-12H,3,6-8H2
InChIKey JMNMSOVWHMQMIE-UHFFFAOYSA-N
Mol Weight 198.28 g/mol
Molecular Formula C10H14O2S
Exact Mass 198.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvzRY0j0XgQ
Name Benzenemethanol, 2-[(3-hydroxypropyl)thio]-
Alternate Name(s) 3-{[2-(hydroxymethyl)phenyl]sulfanyl}-1-propanol O-(hydroxymethyl)phenylthiopropan-1-ol 3-[[2-(hydroxymethyl)phenyl]thio]-1-propanol 3-[2-(hydroxymethyl)phenyl]sulfanylpropan-1-ol
CAS Registry Number 122476-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2S
InChI InChI=1S/C10H14O2S/c11-6-3-7-13-10-5-2-1-4-9(10)8-12/h1-2,4-5,11-12H,3,6-8H2
InChIKey JMNMSOVWHMQMIE-UHFFFAOYSA-N
Molecular Weight 198.280 g/mol
SMILES OCCCSc1c(CO)cccc1
SPLASH splash10-002b-2900000000-b32ab77fc6cca1178226
Source of Spectrum B-41-1951-15
Wiley ID 1195142