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Phenol, 4-(5,6,7,8-tetrahydro-6,7-dimethylnaphtho[2,3-d]-1,3-dioxol-5-yl)-, acetate, [5S-(5.alpha.,6.beta.,7.alpha.)]-
SpectraBase Compound ID 7AM4cqWgmwu
InChI InChI=1S/C21H22O4/c1-12-8-16-9-19-20(24-11-23-19)10-18(16)21(13(12)2)15-4-6-17(7-5-15)25-14(3)22/h4-7,9-10,12-13,21H,8,11H2,1-3H3/t12-,13+,21+/m0/s1
InChIKey WWEFPFBVCVBHLP-OSRJUQGESA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5l2SSArxYrQ
Name Phenol, 4-(5,6,7,8-tetrahydro-6,7-dimethylnaphtho[2,3-d]-1,3-dioxol-5-yl)-, acetate, [5S-(5.alpha.,6.beta.,7.alpha.)]-
Alternate Name(s) 4-[(5R,6R,7S)-6,7-dimethyl-5,6,7,8-tetrahydronaphtho[2,3-d][1,3]dioxol-5-yl]phenyl acetate Acetylattenuol Attenuol monoacetate Naphtho[2,3-d]-1,3-dioxole, phenol deriv.
CAS Registry Number 66761-38-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-12-8-16-9-19-20(24-11-23-19)10-18(16)21(13(12)2)15-4-6-17(7-5-15)25-14(3)22/h4-7,9-10,12-13,21H,8,11H2,1-3H3/t12-,13+,21+/m0/s1
InChIKey WWEFPFBVCVBHLP-OSRJUQGESA-N
Molecular Weight 338.403 g/mol
SMILES c12c(C[C@@]([C@]([C@@]2(c2ccc(OC(=O)C)cc2)[H])(C)[H])(C)[H])cc2c(c1)OCO2
SPLASH splash10-0079-0192000000-43ff4ac34164e1f27ca1
Source of Spectrum F-35-1670-0
Wiley ID 1333975