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ETHYL-CIS-7-MERCAPTOSPIRO-[2.4]-HEPT-5-ENE-4-CARBOXYLATE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

ETHYL-CIS-7-MERCAPTOSPIRO-[2.4]-HEPT-5-ENE-4-CARBOXYLATE
SpectraBase Compound ID DbCo1r1MvJZ
InChI InChI=1S/C10H14O2S/c1-2-12-9(11)7-3-4-8(13)10(7)5-6-10/h3-4,7-8,13H,2,5-6H2,1H3/t7-,8-/m0/s1
InChIKey YAVRDQKISYAADL-YUMQZZPRSA-N
Mol Weight 198.28 g/mol
Molecular Formula C10H14O2S
Exact Mass 198.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXrSqRFXLPb
Name (4R,7S)-7-mercapto-4-spiro[2.4]hept-5-enecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2S
InChI InChI=1S/C10H14O2S/c1-2-12-9(11)7-3-4-8(13)10(7)5-6-10/h3-4,7-8,13H,2,5-6H2,1H3/t7-,8-/m0/s1
InChIKey YAVRDQKISYAADL-YUMQZZPRSA-N
Molecular Weight 198.280 g/mol
SMILES S[C@]1(C=C[C@](C11CC1)(C(=O)OCC)[H])[H]
SPLASH splash10-004l-9200000000-99eccd21c1541f0fcd1a
Source of Spectrum J-67-3685-7
Synonyms (4R,7S)-7-mercaptospiro[2.4]hept-5-ene-4-carboxylic acid ethyl ester Ethyl (4R,7S)-7-sulfanylspiro[2.4]hept-5-ene-4-carboxylate
Wiley ID 1569916