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7-Isopropyl-4,5,6,7,8,9-hexahydro-3H-benzo[b]oxepin-2-one
SpectraBase Compound ID 8MdCFEKo1mw
InChI InChI=1S/C13H20O2/c1-9(2)10-6-7-12-11(8-10)4-3-5-13(14)15-12/h9-10H,3-8H2,1-2H3
InChIKey DYHDDUCXPWDGGO-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8PGhZNtZRVX
Name 7-Isopropyl-4,5,6,7,8,9-hexahydro-3H-benzo[b]oxepin-2-one
Alternate Name(s) 7-isopropyl-4,5,6,7,8,9-hexahydro-1-benzoxepin-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9(2)10-6-7-12-11(8-10)4-3-5-13(14)15-12/h9-10H,3-8H2,1-2H3
InChIKey DYHDDUCXPWDGGO-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES C1=2OC(=O)CCCC2CC(CC1)C(C)C
SPLASH splash10-0536-9510000000-d046ce871ffae039e598
Source of Spectrum AT-39-9648-5
Wiley ID 854344