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1,3,4,5-Tetrahydro-4,8-dimethyl-2-benzoxepine
SpectraBase Compound ID EUUzo5TUIWN
InChI InChI=1S/C12H16O/c1-9-3-4-11-6-10(2)7-13-8-12(11)5-9/h3-5,10H,6-8H2,1-2H3
InChIKey UGHSXXDMNNKZEX-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hRHGohwps
Name 1,3,4,5-Tetrahydro-4,8-dimethyl-2-benzoxepine
Alternate Name(s) 4,8-Dimethyl-1,3,4,5-tetrahydro-2-benzoxepin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9-3-4-11-6-10(2)7-13-8-12(11)5-9/h3-5,10H,6-8H2,1-2H3
InChIKey UGHSXXDMNNKZEX-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES c12c(cc(cc2)C)COCC(C1)C
SPLASH splash10-069u-2900000000-033ecab6e139f7fb8938
Source of Spectrum H-79-1104-10
Wiley ID 1172811