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1,4-Dimethylpent-2-ynyl N-phenylcarbamate
SpectraBase Compound ID EhzEEYzmtoO
InChI InChI=1S/C14H17NO2/c1-11(2)9-10-12(3)17-14(16)15-13-7-5-4-6-8-13/h4-8,11-12H,1-3H3,(H,15,16)
InChIKey QRFSKKXLZNMSGA-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VprberVxWe
Name 1,4-Dimethylpent-2-ynyl N-phenylcarbamate
Alternate Name(s) 5-Methylhex-3-yn-2-yl N-phenylcarbamate N-phenylcarbamic acid 1,4-dimethylpent-2-ynyl ester N-phenylcarbamic acid 5-methylhex-3-yn-2-yl ester
CAS Registry Number 115884-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-11(2)9-10-12(3)17-14(16)15-13-7-5-4-6-8-13/h4-8,11-12H,1-3H3,(H,15,16)
InChIKey QRFSKKXLZNMSGA-UHFFFAOYSA-N
Molecular Weight 231.295 g/mol
SMILES N(C(OC(C#CC(C)C)C)=O)c1ccccc1
SPLASH splash10-0a4i-9010000000-3e3141f316ee26b4abf7
Source of Spectrum KC-1987-2271-5
Wiley ID 1232914