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18[O]-(E)-2-(1-phenylbut-3-en-1-ylidene)cyclobutan-1-one
SpectraBase Compound ID 8ZQU4fujKxc
InChI InChI=1S/C14H14O/c1-2-6-12(13-9-10-14(13)15)11-7-4-3-5-8-11/h2-5,7-8H,1,6,9-10H2/b13-12+/i15+2
InChIKey STFCNBVNEFBZQU-FNJMTGBLSA-N
Mol Weight 200.27 g/mol
Molecular Formula C14H1418O
Exact Mass 200.10871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YxCoSmc8vm
Name 18[O]-(E)-2-(1-phenylbut-3-en-1-ylidene)cyclobutan-1-one
Comments Original formula: C14H14[18O]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O
InChI InChI=1S/C14H14O/c1-2-6-12(13-9-10-14(13)15)11-7-4-3-5-8-11/h2-5,7-8H,1,6,9-10H2/b13-12+/i15+2
InChIKey STFCNBVNEFBZQU-FNJMTGBLSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900053
Molecular Weight 200.265 g/mol
SMILES C1C(\C(C1)=C/(CC=C)c1ccccc1)=[18O]
SPLASH splash10-002f-2900000000-38ef67f6dd2e91f83fe2
Source of Spectrum ASC-361-SM11-2a-[18]O
Wiley ID 1835273