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CROCUSATIN-A
SpectraBase Compound ID DbghCRdmrN2
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4,7,10H,5H2,1-3H3/t7-/m0/s1
InChIKey CZWSBAFIAZKCRV-ZETCQYMHSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Af0lu7Dv32L
Name (4R)-2,6,6-trimethyl-4-oxidanyl-cyclohex-2-en-1-one
Alternate Name(s) (4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enone (4R)-4-hydroxy-2,6,6-trimethyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4,7,10H,5H2,1-3H3/t7-/m0/s1
InChIKey CZWSBAFIAZKCRV-ZETCQYMHSA-N
Molecular Weight 154.209 g/mol
SMILES O[C@@]1(CC(C(C(=C1)C)=O)(C)C)[H]
SPLASH splash10-0002-9300000000-c8bc966790d071db2732
Source of Spectrum B-48-145-0
Wiley ID 1151389