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5,5-Dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-2-ol and 4-(2'-hydroxyphenyl)-4-methylpentanal
SpectraBase Compound ID 9FKbwR6j6ac
InChI InChI=1S/C12H16O2/c1-12(2)8-7-11(13)14-10-6-4-3-5-9(10)12/h3-6,11,13H,7-8H2,1-2H3
InChIKey VOMZKBMSESVZAK-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6GE6BS9DZz
Name 5,5-Dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-2-ol and 4-(2'-hydroxyphenyl)-4-methylpentanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-12(2)8-7-11(13)14-10-6-4-3-5-9(10)12/h3-6,11,13H,7-8H2,1-2H3
InChIKey VOMZKBMSESVZAK-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES OC1Oc2c(C(C)(C)CC1)cccc2
SPLASH splash10-000i-1900000000-c3a12a8887c0e2ad6399
Source of Spectrum B-45-21-0
Synonyms 5,5-Dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-2-ol
Wiley ID 1188792