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2-Cyclohexene-1-acetaldehyde, 6-methyl-6-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [1.alpha.(S*),2.beta.]-(.+-.)-
SpectraBase Compound ID DAOuQnMvtZh
InChI InChI=1S/C20H24O3/c1-20(11-4-3-5-15(20)10-12-21)18-9-6-14-13-16(23-2)7-8-17(14)19(18)22/h3,5,7-8,12-13,15,18H,4,6,9-11H2,1-2H3/t15-,18-,20+/m1/s1
InChIKey USIPPXUYADJQBQ-ZTNFWEORSA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69M5f8CVQtM
Name 2-Cyclohexene-1-acetaldehyde, 6-methyl-6-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [1.alpha.(S*),2.beta.]-(.+-.)-
Alternate Name(s) 2-[2-formylmethyl-1-methylcyclohex-3-enyl]-6-methoxy-3,4-dihydronaphthalen-1-(2H)-one {(1S,6S)-6-[(2S)-6-methoxy-1-oxo-1,2,3,4-tetrahydro-2-naphthalenyl]-6-methyl-2-cyclohexen-1-yl}acetaldehyde
CAS Registry Number 84994-85-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-20(11-4-3-5-15(20)10-12-21)18-9-6-14-13-16(23-2)7-8-17(14)19(18)22/h3,5,7-8,12-13,15,18H,4,6,9-11H2,1-2H3/t15-,18-,20+/m1/s1
InChIKey USIPPXUYADJQBQ-ZTNFWEORSA-N
Molecular Weight 312.409 g/mol
SMILES C1([C@]([C@@]2([C@](C=CCC2)(CC=O)[H])C)(CCc2c1ccc(OC)c2)[H])=O
SPLASH splash10-004i-0952000000-4c0636633386c86a0050
Source of Spectrum KC-1982-2637-0
Wiley ID 1313684