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1,1-Dimethyl-3,4,5,10b-tetrahydro-1H-indeno[1,2-c]oxepine
SpectraBase Compound ID ITqkZpt7eMy
InChI InChI=1S/C15H18O/c1-15(2)14-12(7-5-9-16-15)10-11-6-3-4-8-13(11)14/h3-4,6,8,10,14H,5,7,9H2,1-2H3
InChIKey PQNGSDWENJZZLH-UHFFFAOYSA-N
Mol Weight 214.31 g/mol
Molecular Formula C15H18O
Exact Mass 214.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAFeOJnVI
Name 1,1-Dimethyl-3,4,5,10b-tetrahydro-1H-indeno[1,2-c]oxepine
Appearance Yellow oil
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Exact Mass 214.135765199 u
Formula C15H18O
GC Column HP-5MS
InChI InChI=1S/C15H18O/c1-15(2)14-12(7-5-9-16-15)10-11-6-3-4-8-13(11)14/h3-4,6,8,10,14H,5,7,9H2,1-2H3
InChIKey PQNGSDWENJZZLH-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405789
Molecular Weight 214.308 g/mol
Quality 115
Reported Formula C15H18O
SMILES CC1(OCCCC=2C1C1=C(C2)C=CC=C1)C
SPLASH splash10-000t-9020000000-753dc603960263339bd1
Source of Spectrum QE-21-SM31-15c (DOI: 10.1002/chem.201405789)
Thin-Layer Chromatography 0.19 (hexane/EtOAc, 20:1)
Wiley ID 1907686