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Spiro[cyclohexane-1,2'-[4H-1,3]dioxolo[4,5-c]pyrrol]-4'-one, 5'-[3-(1,3-dithian-2-ylidene)propyl]tetrahydro-6'-hydroxy-
SpectraBase Compound ID IOMvPP5xlTf
InChI InChI=1S/C17H25NO4S2/c19-15-13-14(22-17(21-13)7-2-1-3-8-17)16(20)18(15)9-4-6-12-23-10-5-11-24-12/h6,13-15,19H,1-5,7-11H2/t13-,14+,15?/m0/s1
InChIKey YOFQOJIHSWTADK-SNTRVMSOSA-N
Mol Weight 371.51 g/mol
Molecular Formula C17H25NO4S2
Exact Mass 371.122501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tTBfhtMEyx
Name Spiro[cyclohexane-1,2'-[4H-1,3]dioxolo[4,5-c]pyrrol]-4'-one, 5'-[3-(1,3-dithian-2-ylidene)propyl]tetrahydro-6'-hydroxy-
CAS Registry Number 98634-51-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4S2
InChI InChI=1S/C17H25NO4S2/c19-15-13-14(22-17(21-13)7-2-1-3-8-17)16(20)18(15)9-4-6-12-23-10-5-11-24-12/h6,13-15,19H,1-5,7-11H2/t13-,14+,15?/m0/s1
InChIKey YOFQOJIHSWTADK-SNTRVMSOSA-N
Molecular Weight 371.510 g/mol
SMILES OC1[C@@]2([C@](C(N1CCC=C1SCCCS1)=O)(OC1(CCCCC1)O2)[H])[H]
SPLASH splash10-0bti-0910000000-b1c0c9ed660262982b40
Source of Spectrum J-50-4429-13
Synonyms (3aS,6aR)-5-[3-(1,3-dithian-2-ylidene)propyl]-4-hydroxy-tetrahydro-3aH-spiro[[1,3]dioxolo[4,5-c]pyrrole-2,1'-cyclohexane]-6-one N-[3-(1,3-diathian-2-ylidene)propyl]-3(R),4(S)-(cyclohexylidenedioxy)-5-hydroxy-2-pyrrolidinone
Wiley ID 1354866