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2-Naphthalenecarboxylic acid, 3-[2-(1,3-dioxolan-2-yl)ethyl]-1,2,3,4-tetrahydro-7-methoxy-1-phenyl-, (1.alpha.,2.beta.,3.alpha.)-(.+-.)-
SpectraBase Compound ID IO8vKzeMWgC
InChI InChI=1S/C23H26O5/c1-26-18-9-7-16-13-17(8-10-20-27-11-12-28-20)22(23(24)25)21(19(16)14-18)15-5-3-2-4-6-15/h2-7,9,14,17,20-22H,8,10-13H2,1H3,(H,24,25)/t17-,21+,22+/m1/s1
InChIKey XYLVDQFNLGRIJJ-WTNAPCKOSA-N
Mol Weight 382.46 g/mol
Molecular Formula C23H26O5
Exact Mass 382.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GfLet3dur9
Name 2-Naphthalenecarboxylic acid, 3-[2-(1,3-dioxolan-2-yl)ethyl]-1,2,3,4-tetrahydro-7-methoxy-1-phenyl-, (1.alpha.,2.beta.,3.alpha.)-(.+-.)-
CAS Registry Number 120981-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O5
InChI InChI=1S/C23H26O5/c1-26-18-9-7-16-13-17(8-10-20-27-11-12-28-20)22(23(24)25)21(19(16)14-18)15-5-3-2-4-6-15/h2-7,9,14,17,20-22H,8,10-13H2,1H3,(H,24,25)/t17-,21+,22+/m1/s1
InChIKey XYLVDQFNLGRIJJ-WTNAPCKOSA-N
Molecular Weight 382.456 g/mol
SMILES OC([C@@]1([C@](c2c(C[C@]1(CCC1OCCO1)[H])ccc(c2)OC)(c1ccccc1)[H])[H])=O
SPLASH splash10-00di-9067000000-5c2b06af99d582f806c3
Source of Spectrum H-71-1701-16
Synonyms (1S,2S,3R)-3-[2-(1,3-dioxolan-2-yl)ethyl]-7-methoxy-1-phenyl-1,2,3,4-tetrahydro-2-naphthalenecarboxylic acid 2-Naphthalenecarboxylic acid c-3-[2-(1,3-dioxan-2-yl)ethyl]-1,2,3,4-tetrahydro-7-methoxy-r-1-phenylnaphthalene-t-2-carboxylic acid
Wiley ID 1360694