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1,4-Propenoisobenzofuran-3(1H)-one, 3a,4,7,7a-tetrahydro-5,7a,9-trimethyl-
SpectraBase Compound ID 6UbA3hQjRhI
InChI InChI=1S/C14H18O2/c1-9-4-5-13(2)6-7-14(3)8-10(9)11(13)12(15)16-14/h4,6-7,10-11H,5,8H2,1-3H3/t10-,11+,13-,14-/m0/s1
InChIKey VTTJIUYJQLPLMM-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E0LKarcKtU
Name 1,4-Propenoisobenzofuran-3(1H)-one, 3a,4,7,7a-tetrahydro-5,7a,9-trimethyl-
CAS Registry Number 64738-87-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-9-4-5-13(2)6-7-14(3)8-10(9)11(13)12(15)16-14/h4,6-7,10-11H,5,8H2,1-3H3/t10?,11-,13-,14-/m0/s1
InChIKey VTTJIUYJQLPLMM-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES C1([C@@]2(C3C(C)=CC[C@]2(C=C[C@](O1)(C3)C)C)[H])=O
SPLASH splash10-0a4i-1900000000-e83d7824274ee7357573
Source of Spectrum H-60-1957-0
Synonyms 3,9-Methano-2-benzoxepin-1(3H)-one, 5a,6,9,9a-tetrahydro-3,5a,8-trimethyl- 1,4,7-Trimethyl-11-oxa-tricyclo(6.3.1.0*4,9)dodeca-2,6-dien-10-one 1,4,7-trimethyl-11-oxatricyclo[6.3.1.0(4,9)]dodeca-2,6-dien-10-one 3,6,9-Trimethyl-12-oxa-tricyclo(7.3.0.0*5,10)dodeca-2,6-dien-11-one
Wiley ID 1217953