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Spiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxol]-4'(3'aH)-one, dihydro-6'-phenyl-, [3'aR-(3'a.alpha.,6'.alpha.,6'a.alpha.)]-

View entire compound with spectra: 1 MS (GC)

Spiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxol]-4'(3'aH)-one, dihydro-6'-phenyl-, [3'aR-(3'a.alpha.,6'.alpha.,6'a.alpha.)]-
SpectraBase Compound ID Cfx4E12hzBN
InChI InChI=1S/C16H18O4/c17-15-14-13(12(18-15)11-7-3-1-4-8-11)19-16(20-14)9-5-2-6-10-16/h1,3-4,7-8,12-14H,2,5-6,9-10H2/t12-,13-,14+/m0/s1
InChIKey TZIVQWXYFCZIGA-MELADBBJSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14VWgkJrtyX
Name Spiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxol]-4'(3'aH)-one, dihydro-6'-phenyl-, [3'aR-(3'a.alpha.,6'.alpha.,6'a.alpha.)]-
Alternate Name(s) (3'aS,4'S,6'aR)-4'-phenyl-tetrahydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxole]-6'-one 2,3-O-cyclohexylidene-4-c-phenyl-L-lyxo-tetronolactones
CAS Registry Number 85254-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c17-15-14-13(12(18-15)11-7-3-1-4-8-11)19-16(20-14)9-5-2-6-10-16/h1,3-4,7-8,12-14H,2,5-6,9-10H2/t12-,13-,14+/m0/s1
InChIKey TZIVQWXYFCZIGA-MELADBBJSA-N
Molecular Weight 274.316 g/mol
SMILES [C@]12([C@]([C@](c3ccccc3)(OC1=O)[H])(OC1(O2)CCCCC1)[H])[H]
SPLASH splash10-0kai-8950000000-862e49e3cd194d2d099e
Source of Spectrum H-65-2577-0
Wiley ID 1278197