(4aR,5S,7R,8S)-4a-Cyano-8-(1,3-dioxalan-2-yl)-5-isopropenyl-7,8-dimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one

SpectraBase Compound ID	1jN57OgUUCK
InChI	InChI=1S/C19H25NO3/c1-12(2)15-9-13(3)18(4,17-22-7-8-23-17)16-10-14(21)5-6-19(15,16)11-20/h10,13,15,17H,1,5-9H2,2-4H3/t13-,15+,18+,19-/m1/s1
InChIKey	VRGBPGXQSOKTGL-OPGCRTJHSA-N Google Search
Mol Weight	315.41 g/mol
Molecular Formula	C19H25NO3
Exact Mass	315.183444 g/mol

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SpectraBase Spectrum ID	IpKb9rQrFb
Name	(4aR,5S,7R,8S)-4a-Cyano-8-(1,3-dioxalan-2-yl)-5-isopropenyl-7,8-dimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H25NO3
InChI	InChI=1S/C19H25NO3/c1-12(2)15-9-13(3)18(4,17-22-7-8-23-17)16-10-14(21)5-6-19(15,16)11-20/h10,13,15,17H,1,5-9H2,2-4H3/t13-,15+,18+,19-/m1/s1
InChIKey	VRGBPGXQSOKTGL-OPGCRTJHSA-N
Molecular Weight	315.413 g/mol
SMILES	C=12[C@@]([C@@](C[C@]([C@@]2(C2OCCO2)C)(C)[H])(C(=C)C)[H])(C#N)CCC(C1)=O
SPLASH	splash10-00di-9000000000-72e1c9de86273d6f6c71
Source of Spectrum	F-56-2092-34
Synonyms	(4aR,5S,7R,8S)-4a-Cyano-8-(1,3-dioxolan-2-yl)-5-isopropenyl-7,8-dimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one (1S,2R,4S,4aR)-1-(1,3-dioxolan-2-yl)-1,2-dimethyl-4-(1-methylethenyl)-7-oxo-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (1S,2R,4S,4aR)-1-(1,3-dioxolan-2-yl)-1,2-dimethyl-7-oxo-4-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (1S,2R,4S,4aR)-1-(1,3-dioxolan-2-yl)-4-isopropenyl-1,2-dimethyl-7-oxo-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (1S,2R,4S,4aR)-1-(1,3-dioxolan-2-yl)-1,2-dimethyl-7-oxidanylidene-4-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile
Wiley ID	856343