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1-Azaspiro[4.5]dec-1-ene-3,4-dicarboxylic acid, 2-[(phenylmethyl)thio]-, dimethyl ester, trans-
SpectraBase Compound ID LJNgBYCjRP6
InChI InChI=1S/C20H25NO4S/c1-24-18(22)15-16(19(23)25-2)20(11-7-4-8-12-20)21-17(15)26-13-14-9-5-3-6-10-14/h3,5-6,9-10,15-16H,4,7-8,11-13H2,1-2H3/t15-,16+/m1/s1
InChIKey WENXNFQAIBQRTQ-CVEARBPZSA-N
Mol Weight 375.48 g/mol
Molecular Formula C20H25NO4S
Exact Mass 375.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SjcVJuzEq5
Name 1-Azaspiro[4.5]dec-1-ene-3,4-dicarboxylic acid, 2-[(phenylmethyl)thio]-, dimethyl ester, trans-
CAS Registry Number 119216-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25NO4S
InChI InChI=1S/C20H25NO4S/c1-24-18(22)15-16(19(23)25-2)20(11-7-4-8-12-20)21-17(15)26-13-14-9-5-3-6-10-14/h3,5-6,9-10,15-16H,4,7-8,11-13H2,1-2H3/t15-,16+/m1/s1
InChIKey WENXNFQAIBQRTQ-CVEARBPZSA-N
Molecular Weight 375.483 g/mol
SMILES C1(=NC2(CCCCC2)[C@@]([C@]1(C(=O)OC)[H])(C(=O)OC)[H])SCc1ccccc1
SPLASH splash10-0006-9213000000-f50eeaaf7e0a45edcecd
Source of Spectrum H-71-1187-9
Synonyms Dimethyl (3S,4R)-2-(benzylsulfanyl)-1-azaspiro[4.5]dec-1-ene-3,4-dicarboxylate Dimethyl 5'-(benzylthio)spiro[cyclohexane-1,2'-[3,4]dihydro-2'h-pyrrole]-3',4'-dicarboxylate
Wiley ID 1357162