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1,3-Dioxolane-4-carboxaldehyde, 5-(4-methoxyphenyl)-2,2-dimethyl-, (4S-trans)-
SpectraBase Compound ID A62s9ylPkFY
InChI InChI=1S/C13H16O4/c1-13(2)16-11(8-14)12(17-13)9-4-6-10(15-3)7-5-9/h4-8,11-12H,1-3H3/t11-,12-/m1/s1
InChIKey PQPQKAWWRNSCHO-VXGBXAGGSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeqbbuLsL4h
Name 1,3-Dioxolane-4-carboxaldehyde, 5-(4-methoxyphenyl)-2,2-dimethyl-, (4S-trans)-
CAS Registry Number 130796-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-13(2)16-11(8-14)12(17-13)9-4-6-10(15-3)7-5-9/h4-8,11-12H,1-3H3/t11-,12-/m1/s1
InChIKey PQPQKAWWRNSCHO-VXGBXAGGSA-N
Molecular Weight 236.267 g/mol
SMILES C1(O[C@](C=O)([C@](O1)(c1ccc(cc1)OC)[H])[H])(C)C
SPLASH splash10-0f79-8900000000-e2b3a49667b696671dec
Source of Spectrum B-43-1208-0
Synonyms (4S,5R)-5-(4-methoxyphenyl)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde (4S,5R)-trans-5-(4-methoxyphenyl)-2,2-dimethyl-1,3-dioxolan-4-carbaldehyde
Wiley ID 1238101