For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(3-Hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-10-yl)propan-1-one

View entire compound with spectra: 1 MS (GC)

1-(3-Hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-10-yl)propan-1-one
SpectraBase Compound ID BnxCCSwUe0o
InChI InChI=1S/C18H22O3/c1-4-15(20)12-6-5-7-14-17(12)13-9-8-11(19)10-16(13)21-18(14,2)3/h7-10,12,17,19H,4-6H2,1-3H3/t12-,17-/m1/s1
InChIKey AJMRKYJUHLSPHA-SJKOYZFVSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID C8HuTuH71Bn
Name 1-(3-Hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-10-yl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-4-15(20)12-6-5-7-14-17(12)13-9-8-11(19)10-16(13)21-18(14,2)3/h7-10,12,17,19H,4-6H2,1-3H3/t12-,17-/m1/s1
InChIKey AJMRKYJUHLSPHA-SJKOYZFVSA-N
Literature Reference DOI 10.1021/co200107s
Molecular Weight 286.371 g/mol
SMILES Oc1cc2c(cc1)[C@@]1(C(C(C)(C)O2)=CCC[C@@]1(C(=O)CC)[H])[H]
SPLASH splash10-0f89-9460000000-2e5a5e6c9cd56c76fe26
Source of Spectrum ACS-13-554/SM26-21{2,4}_Exo
Synonyms 1-((10S,10aR)-3-hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-10-yl)propan-1-one 1-[(10S,10aS)-3-hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydrobenzo[c][1]benzopyran-10-yl]-1-propanone 1-[(10S,10aS)-6,6-dimethyl-3-oxidanyl-8,9,10,10a-tetrahydrobenzo[c]chromen-10-yl]propan-1-one
Wiley ID 1754083