John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6BkDvTvfYfu SpectraBase Spectrum ID=5hPoMk8i6sq

(accessed ).
1-naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.-hydroxy-.beta.,2,5,5,8a-pentamethyl-3-oxo-, methyl ester, [4aS-[1-(R*),4a.alpha.,8a.beta.]-
SpectraBase Compound ID 6BkDvTvfYfu
InChI InChI=1S/C21H34O4/c1-14-15(8-11-20(4,24)13-18(23)25-6)21(5)10-7-9-19(2,3)17(21)12-16(14)22/h17,24H,7-13H2,1-6H3/t17-,20?,21+/m1/s1
InChIKey ZQRMUUPELZUBGH-LYHOZKKVSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID 5hPoMk8i6sq
Name 1-naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.-hydroxy-.beta.,2,5,5,8a-pentamethyl-3-oxo-, methyl ester, [4aS-[1-(R*),4a.alpha.,8a.beta.]-
Alternate Name(s) Methyl 5-[(4aR,8aR)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]-3-hydroxy-3-methylpentanoate
CAS Registry Number 102505-48-6
Classification Diterpenoids
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-14-15(8-11-20(4,24)13-18(23)25-6)21(5)10-7-9-19(2,3)17(21)12-16(14)22/h17,24H,7-13H2,1-6H3/t17-,20?,21+/m1/s1
InChIKey ZQRMUUPELZUBGH-LYHOZKKVSA-N
SPLASH splash10-004i-2691000000-b323a64527a05dd450ee
Source of Spectrum J-51-2826-6
SpectraBase Batch ID 96wVdeVt07