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3-(Acetylamino)-3-benzyl-5(E)-(bromomethylidene)-tetrahydro-2-furnanone
SpectraBase Compound ID Nd8VJ1GEXo
InChI InChI=1S/C14H14BrNO3/c1-10(17)16-14(7-11-5-3-2-4-6-11)8-12(9-15)19-13(14)18/h2-6,9H,7-8H2,1H3,(H,16,17)/b12-9+
InChIKey IWASCPWAZLMXEN-FMIVXFBMSA-N
Mol Weight 324.17 g/mol
Molecular Formula C14H14BrNO3
Exact Mass 323.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlY4p8AefEX
Name 3-(Acetylamino)-3-benzyl-5(E)-(bromomethylidene)-tetrahydro-2-furnanone
Alternate Name(s) N-[(5E)-3-benzyl-5-(bromomethylene)-2-oxotetrahydro-3-furanyl]acetamide
CAS Registry Number 86748-70-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14BrNO3
InChI InChI=1S/C14H14BrNO3/c1-10(17)16-14(7-11-5-3-2-4-6-11)8-12(9-15)19-13(14)18/h2-6,9H,7-8H2,1H3,(H,16,17)/b12-9+
InChIKey IWASCPWAZLMXEN-FMIVXFBMSA-N
Molecular Weight 324.174 g/mol
SMILES N(C1(C(O\C(C1)=C/Br)=O)Cc1ccccc1)C(=O)C
SPLASH splash10-0006-9020000000-3deae4fdd3fd2cf3bb52
Source of Spectrum J-48-3324-0
Wiley ID 1322303