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6.beta.-formyl-6,7-dihydro-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
SpectraBase Compound ID 1Jxuw8T9NtY
InChI InChI=1S/C12H10O3/c13-6-8-5-7-3-1-2-4-9(7)10(14)12-11(8)15-12/h1-4,6,8,11-12H,5H2/t8-,11?,12+/m0/s1
InChIKey AGXJRZGSIHXPJB-ZRPCIRFQSA-N
Mol Weight 202.21 g/mol
Molecular Formula C12H10O3
Exact Mass 202.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hp43puOaxzF
Name 6.beta.-formyl-6,7-dihydro-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
CAS Registry Number 112218-22-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O3
InChI InChI=1S/C12H10O3/c13-6-8-5-7-3-1-2-4-9(7)10(14)12-11(8)15-12/h1-4,6,8,11-12H,5H2/t8-,11?,12+/m0/s1
InChIKey AGXJRZGSIHXPJB-ZRPCIRFQSA-N
Molecular Weight 202.209 g/mol
SMILES [C@]12(OC2[C@@](Cc2c(C1=O)cccc2)(C=O)[H])[H]
SPLASH splash10-0002-0910000000-5107c97c91b2206dd359
Source of Spectrum KC-1987-200-28
Synonyms (1aS,8R)-2-oxo-2,7,8,8a-tetrahydro-1aH-benzo[4,5]cyclohepta[1,2-b]oxirene-8-carbaldehyde
Wiley ID 1199837