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(4aS,6S,8aS)-1-keto-6,8a-dimethyl-5-methylene-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbaldehyde
SpectraBase Compound ID 9oobFN0Lwuw
InChI InChI=1S/C14H18O2/c1-9-6-7-14(3)12(10(9)2)5-4-11(8-15)13(14)16/h4,8-9,12H,2,5-7H2,1,3H3/t9-,12-,14-/m0/s1
InChIKey KYJDURWKUVXFQR-WFBYXXMGSA-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 1bvEfoWiLQ
Name (4aS,6S,8aS)-1-keto-6,8a-dimethyl-5-methylene-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbaldehyde
CAS Registry Number 100432-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-9-6-7-14(3)12(10(9)2)5-4-11(8-15)13(14)16/h4,8-9,12H,2,5-7H2,1,3H3/t9-,12-,14-/m0/s1
InChIKey KYJDURWKUVXFQR-WFBYXXMGSA-N
Molecular Weight 218.296 g/mol
SMILES [C@@]12([C@](C(=C)[C@](CC2)(C)[H])(CC=C(C1=O)C=O)[H])C
SPLASH splash10-00l6-2920000000-7c0c55b2e36df6010994
Source of Spectrum J-51-782-34
Synonyms (4aS,6S,8aS)-6,8a-dimethyl-5-methylene-1-oxo-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbaldehyde (4aS,6S,8aS)-6,8a-dimethyl-5-methylene-1-oxo-4a,6,7,8-tetrahydro-4H-naphthalene-2-carboxaldehyde (4aS,6S,8aS)-6,8a-dimethyl-5-methylidene-1-oxidanylidene-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbaldehyde (4aS,6S,8aS)-6,8a-dimethyl-5-methylidene-1-oxo-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbaldehyde
Wiley ID 1217997