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(R)-S-naphthalen-1-yl 4-(benzo[d][1,3]dioxol-5-yl)-4-cyano-5-oxohexanethioate

View entire compound with spectra: 1 MS (GC)

(R)-S-naphthalen-1-yl 4-(benzo[d][1,3]dioxol-5-yl)-4-cyano-5-oxohexanethioate
SpectraBase Compound ID 5I1DC0AITbZ
InChI InChI=1S/C24H19NO4S/c1-16(26)24(14-25,18-9-10-20-21(13-18)29-15-28-20)12-11-23(27)30-22-8-4-6-17-5-2-3-7-19(17)22/h2-10,13H,11-12,15H2,1H3/t24-/m1/s1
InChIKey VLQHRTTZNJCFEW-XMMPIXPASA-N
Mol Weight 417.48 g/mol
Molecular Formula C24H19NO4S
Exact Mass 417.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CT92o88lxgh
Name (R)-S-naphthalen-1-yl 4-(benzo[d][1,3]dioxol-5-yl)-4-cyano-5-oxohexanethioate
Alternate Name(s) S-naphthalen-1-yl 4-(benzo[d][1,3]dioxol-5-yl)-4-cyano-5-oxohexanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H19NO4S
InChI InChI=1S/C24H19NO4S/c1-16(26)24(14-25,18-9-10-20-21(13-18)29-15-28-20)12-11-23(27)30-22-8-4-6-17-5-2-3-7-19(17)22/h2-10,13H,11-12,15H2,1H3/t24-/m1/s1
InChIKey VLQHRTTZNJCFEW-XMMPIXPASA-N
Literature Reference DOI 10.1002/asia.201300595
Molecular Weight 417.479 g/mol
SMILES c1(SC(CC[C@@](C(=O)C)(c2ccc3OCOc3c2)C#N)=O)cccc2c1cccc2
SPLASH splash10-02t9-3920000000-0ed06d0808bcb04b23f6
Source of Spectrum CAJ-8-1966/SM15-3g
Wiley ID 1772065