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Sulfuric acid, 3-methylphenyl propyl ester
SpectraBase Compound ID AkHZQmSld4u
InChI InChI=1S/C10H14O4S/c1-3-7-13-15(11,12)14-10-6-4-5-9(2)8-10/h4-6,8H,3,7H2,1-2H3
InChIKey PVOMGPKUEJEGJG-UHFFFAOYSA-N
Mol Weight 230.28 g/mol
Molecular Formula C10H14O4S
Exact Mass 230.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fy8HRZvHb4
Name Sulfuric acid, 3-methylphenyl propyl ester
Alternate Name(s) 3-Methyllphenyl propyl sulfate 3-Methylphenyl propyl sulfate M-methylphenyl propyl sulfate Propyl-m-methylphenyl sulfate
CAS Registry Number 67628-80-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4S
InChI InChI=1S/C10H14O4S/c1-3-7-13-15(11,12)14-10-6-4-5-9(2)8-10/h4-6,8H,3,7H2,1-2H3
InChIKey PVOMGPKUEJEGJG-UHFFFAOYSA-N
Molecular Weight 230.278 g/mol
SMILES c1(OS(=O)(=O)OCCC)cc(C)ccc1
SPLASH splash10-0a4i-0900000000-282c2b737bbe82dfdaee
Source of Spectrum KO-5-130-2
Wiley ID 1231278