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1,3-Dioxolane-4-methanol, 2,2-dimethyl-5-propyl-, (4S-trans)-
SpectraBase Compound ID EvnzFgxwQ36
InChI InChI=1S/C9H18O3/c1-4-5-7-8(6-10)12-9(2,3)11-7/h7-8,10H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey BIWWKAWWWUHFRE-YUMQZZPRSA-N
Mol Weight 174.24 g/mol
Molecular Formula C9H18O3
Exact Mass 174.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6O79x4EjpQz
Name 1,3-Dioxolane-4-methanol, 2,2-dimethyl-5-propyl-, (4S-trans)-
CAS Registry Number 58789-48-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O3
InChI InChI=1S/C9H18O3/c1-4-5-7-8(6-10)12-9(2,3)11-7/h7-8,10H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey BIWWKAWWWUHFRE-YUMQZZPRSA-N
Molecular Weight 174.240 g/mol
SMILES OC[C@@]1(OC(O[C@]1(CCC)[H])(C)C)[H]
SPLASH splash10-0a4i-9200000000-69698423be2f851bc677
Source of Spectrum H-70-1674-8
Synonyms (4S,5S)-2,2-dimethyl-5-propyl-1,3-dioxolane-4-methanol [(4S,5S)-2,2-dimethyl-5-propyl-1,3-dioxolan-4-yl]methanol
Wiley ID 1170582