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(S)-1-(3-(diethoxymethyl)phenyl)-2-(6-methoxynaphthalen-2-yl)propan-1-one
SpectraBase Compound ID JV1pTYn9T0E
InChI InChI=1S/C25H28O4/c1-5-28-25(29-6-2)22-9-7-8-21(15-22)24(26)17(3)18-10-11-20-16-23(27-4)13-12-19(20)14-18/h7-17,25H,5-6H2,1-4H3/t17-/m0/s1
InChIKey VTFHAIBIZJRYQQ-KRWDZBQOSA-N
Mol Weight 392.5 g/mol
Molecular Formula C25H28O4
Exact Mass 392.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 790kq51DZ7I
Name (S)-1-(3-(diethoxymethyl)phenyl)-2-(6-methoxynaphthalen-2-yl)propan-1-one
Appearance Colorless oil
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Exact Mass 392.198759378 u
Formula C25H28O4
InChI InChI=1S/C25H28O4/c1-5-28-25(29-6-2)22-9-7-8-21(15-22)24(26)17(3)18-10-11-20-16-23(27-4)13-12-19(20)14-18/h7-17,25H,5-6H2,1-4H3/t17-/m0/s1
InChIKey VTFHAIBIZJRYQQ-KRWDZBQOSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102805
Molecular Weight 392.495 g/mol
Optical Rotation [a]D20 = 158 (c = 0.99, CHCl3)
Quality 13
Reported Formula C25H28O4
SMILES C(C)OC(OCC)C=1C=C(C=CC1)C([C@@](C)(C1=CC2=C(C=C1)C=C(C=C2)OC)[H])=O
SPLASH splash10-000i-0900000000-3c00f145c3253d885cf6
Source of Spectrum QE-27-SM59-14am (DOI: 10.1002/chem.202102805)
Wiley ID 1902224