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Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-(3,4,5-trimethoxyphenyl)-, [5R-(5.alpha.,6.alpha.,7.beta.)]-
SpectraBase Compound ID AUV5NGR4quF
InChI InChI=1S/C22H26O5/c1-12-6-14-7-17-18(27-11-26-17)10-16(14)21(13(12)2)15-8-19(23-3)22(25-5)20(9-15)24-4/h7-10,12-13,21H,6,11H2,1-5H3/t12-,13+,21-/m1/s1
InChIKey OZZUFLDUPKLHBA-RRMDADRESA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cu8xbJzV7T
Name Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-(3,4,5-trimethoxyphenyl)-, [5R-(5.alpha.,6.alpha.,7.beta.)]-
CAS Registry Number 55924-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-12-6-14-7-17-18(27-11-26-17)10-16(14)21(13(12)2)15-8-19(23-3)22(25-5)20(9-15)24-4/h7-10,12-13,21H,6,11H2,1-5H3/t12-,13+,21-/m1/s1
InChIKey OZZUFLDUPKLHBA-RRMDADRESA-N
Molecular Weight 370.445 g/mol
SMILES c12[C@@](c3cc(OC)c(c(c3)OC)OC)([C@@](C)([C@@](Cc1cc1c(c2)OCO1)(C)[H])[H])[H]
SPLASH splash10-00di-0149000000-e2003390ed3b075673d2
Source of Spectrum B-28-89-0
Synonyms (5R,6S,7R)-6,7-dimethyl-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydronaphtho[2,3-d][1,3]dioxole Austrobailignan 4
Wiley ID 1354453