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Pent-4-yn-1-yl 4-methylbenzenesulfonate

View entire compound with spectra: 3 MS (GC)

Pent-4-yn-1-yl 4-methylbenzenesulfonate
SpectraBase Compound ID DTdIVENdVLp
InChI InChI=1S/C12H14O3S/c1-3-4-5-10-15-16(13,14)12-8-6-11(2)7-9-12/h1,6-9H,4-5,10H2,2H3
InChIKey HUDMRXOBWIYVMZ-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyiGMdJ7ReC
Name 4-Pentyn-1-yl para-toluenesulfonate
Alternate Name(s) 4-Pentynyl 4-methylbenzenesulfonate Pent-4-ynyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-3-4-5-10-15-16(13,14)12-8-6-11(2)7-9-12/h1,6-9H,4-5,10H2,2H3
InChIKey HUDMRXOBWIYVMZ-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES c1(S(=O)(=O)OCCCC#C)ccc(cc1)C
SPLASH splash10-0006-9500000000-2ca2b15fdf7f83b8eb2c
Source of Spectrum F-52-7787-14
Wiley ID 797037