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1,3-Propanediol, 1-(4-chlorophenyl)-2-(hydroxymethyl)-2-methyl-, 3-carbamate
SpectraBase Compound ID 59dPIo1sZQM
InChI InChI=1S/C12H16ClNO4/c1-12(6-15,7-18-11(14)17)10(16)8-2-4-9(13)5-3-8/h2-5,10,15-16H,6-7H2,1H3,(H2,14,17)
InChIKey OAWNVSQSLYHRRU-UHFFFAOYSA-N
Mol Weight 273.72 g/mol
Molecular Formula C12H16ClNO4
Exact Mass 273.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cp2r9yVjSPU
Name 1,3-Propanediol, 1-(4-chlorophenyl)-2-(hydroxymethyl)-2-methyl-, 3-carbamate
CAS Registry Number 31758-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO4
InChI InChI=1S/C12H16ClNO4/c1-12(6-15,7-18-11(14)17)10(16)8-2-4-9(13)5-3-8/h2-5,10,15-16H,6-7H2,1H3,(H2,14,17)
InChIKey OAWNVSQSLYHRRU-UHFFFAOYSA-N
Molecular Weight 273.716 g/mol
SMILES OC(C(CO)(COC(=O)N)C)c1ccc(cc1)Cl
SPLASH splash10-006x-9500000000-d70fb0a3377b2e187382
Source of Spectrum AF-14-388-3
Synonyms 1,3-Propanediol, 1-(p-chlorophenyl)-2-(hydroxymethyl)-2-methyl-, 3-carbamate 1-(p-chlorophenyl)-2-hydroxymethyl-2-methyl-1,3propanediol 3 carbamate 1-Amido-2,2-methylhydroxymethyl-3,3-hydroxy-p-benzylchloride 3-(4-Chlorophenyl)-3-hydroxy-2-(hydroxymethyl)-2-methylpropyl carbamate
Wiley ID 1277022