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3-Dodecen-2-one, 1-phenyl-, (E)-
SpectraBase Compound ID 9NsAQNMweBo
InChI InChI=1S/C18H26O/c1-2-3-4-5-6-7-8-12-15-18(19)16-17-13-10-9-11-14-17/h9-15H,2-8,16H2,1H3/b15-12+
InChIKey HLKZMFFVKUKMMO-NTCAYCPXSA-N
Mol Weight 258.4 g/mol
Molecular Formula C18H26O
Exact Mass 258.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2nrM4XrX0A
Name 3-Dodecen-2-one, 1-phenyl-, (E)-
Alternate Name(s) (3E)-1-phenyl-3-dodecen-2-one 1-Phenyl-3-dodecen-2-one (E)-1-phenyl-3-dodecen-2-one
CAS Registry Number 111036-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O
InChI InChI=1S/C18H26O/c1-2-3-4-5-6-7-8-12-15-18(19)16-17-13-10-9-11-14-17/h9-15H,2-8,16H2,1H3/b15-12+
InChIKey HLKZMFFVKUKMMO-NTCAYCPXSA-N
Molecular Weight 258.405 g/mol
SMILES C(\C=C\CCCCCCCC)(=O)Cc1ccccc1
SPLASH splash10-014i-0900000000-7c7c8e9470c1098b9d04
Source of Spectrum AJ-60-1845-26
Wiley ID 1262314