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Phosphoric acid, bis(2,6-dimethoxyphenyl) 1,4,4a,5,6,7,8,8a-octahydro-4a-methyl-5-oxo-2-naphthalenyl ester, cis-
SpectraBase Compound ID FFvzNvCs27i
InChI InChI=1S/C27H33O9P/c1-27-16-15-19(17-18(27)9-6-14-24(27)28)34-37(29,35-25-20(30-2)10-7-11-21(25)31-3)36-26-22(32-4)12-8-13-23(26)33-5/h7-8,10-13,15,18H,6,9,14,16-17H2,1-5H3/t18-,27+/m0/s1
InChIKey RBGIVVTUDMVBDG-XRHLQHRESA-N
Mol Weight 532.5 g/mol
Molecular Formula C27H33O9P
Exact Mass 532.18622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtMUqm12KaO
Name Phosphoric acid, bis(2,6-dimethoxyphenyl) 1,4,4a,5,6,7,8,8a-octahydro-4a-methyl-5-oxo-2-naphthalenyl ester, cis-
CAS Registry Number 113947-81-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33O9P
InChI InChI=1S/C27H33O9P/c1-27-16-15-19(17-18(27)9-6-14-24(27)28)34-37(29,35-25-20(30-2)10-7-11-21(25)31-3)36-26-22(32-4)12-8-13-23(26)33-5/h7-8,10-13,15,18H,6,9,14,16-17H2,1-5H3/t18-,27+/m0/s1
InChIKey RBGIVVTUDMVBDG-XRHLQHRESA-N
Molecular Weight 532.526 g/mol
SMILES c1(OP(Oc2c(OC)cccc2OC)(OC2=CC[C@@]3([C@](C2)(CCCC3=O)[H])C)=O)c(OC)cccc1OC
SPLASH splash10-0udi-4879010000-ba71dd4b9619a4ebaa61
Source of Spectrum J-53-2299-24
Synonyms (4aR,8aS)-4a-methyl-5-oxo-1,4,4a,5,6,7,8,8a-octahydro-2-naphthalenyl bis(2,6-dimethoxyphenyl) phosphate (Di(2,6-dimethoxybenzoyl)((9')-6'-methyl-5'-oxo-bicyclo[4.4.0]deca-8'-nenyl)phosphate
Wiley ID 1403576