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3-((6R,8aR)-6-Benzyloxy-8a-methyl-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-3-oxo-propionic acid allyl ester
SpectraBase Compound ID IdrM5E02XI8
InChI InChI=1S/C24H30O4/c1-3-14-27-23(26)16-22(25)21-11-7-10-19-15-20(12-13-24(19,21)2)28-17-18-8-5-4-6-9-18/h3-6,8-9,11,19-20H,1,7,10,12-17H2,2H3/t19?,20-,24-/m1/s1
InChIKey SNRFMPLLBKQIEO-ALRZPZFWSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkGIuAl8FNR
Name 3-((6R,8aR)-6-Benzyloxy-8a-methyl-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-3-oxo-propionic acid allyl ester
Alternate Name(s) allyl 3-[(6R,8aR)-6-(benzyloxy)-8a-methyl-3,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]-3-oxopropanoate Prop-2'-enyl 3,4,4a,5,6,7,8,8a-octahydro-8a-methyl-6-(phenylmethoxy)naphthalene-1-propanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-3-14-27-23(26)16-22(25)21-11-7-10-19-15-20(12-13-24(19,21)2)28-17-18-8-5-4-6-9-18/h3-6,8-9,11,19-20H,1,7,10,12-17H2,2H3/t19?,20-,24-/m1/s1
InChIKey SNRFMPLLBKQIEO-ALRZPZFWSA-N
Molecular Weight 382.500 g/mol
SMILES [C@]12(C(C(CC(=O)OCC=C)=O)=CCCC2C[C@](OCc2ccccc2)(CC1)[H])C
SPLASH splash10-0006-0091000000-197aed808cd76090bd0f
Source of Spectrum H-86-3737-6
Wiley ID 1525736