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N-(But-3-ynyl)-N-chloromethylbenzamide
SpectraBase Compound ID J7YFcuboMDL
InChI InChI=1S/C12H12ClNO/c1-2-3-9-14(10-13)12(15)11-7-5-4-6-8-11/h1,4-8H,3,9-10H2
InChIKey IDJHRHSVRJBBBV-UHFFFAOYSA-N
Mol Weight 221.69 g/mol
Molecular Formula C12H12ClNO
Exact Mass 221.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CllbLpQFXcQ
Name N-(But-3-ynyl)-N-chloromethylbenzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClNO
InChI InChI=1S/C12H12ClNO/c1-2-3-9-14(10-13)12(15)11-7-5-4-6-8-11/h1,4-8H,3,9-10H2
InChIKey IDJHRHSVRJBBBV-UHFFFAOYSA-N
Molecular Weight 221.687 g/mol
SMILES C(c1ccccc1)(=O)N(CCl)CCC#C
SPLASH splash10-00b9-9810000000-27b3f2d33a87e96db6d5
Source of Spectrum KC-0-2334-0
Synonyms N-(3-butynyl)-N-(chloromethyl)benzamide
Wiley ID 830784