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(1SR,3aSR,5RS,&RS,&ASR)-7a-[3-[(ethoxycarbonyl)-amino]propyl]octahydro-1-[3-[(ethoxycarbonyl)oxy]-propyl]-7-hydroxy-5-methyl-2-methylene-1H-indene
SpectraBase Compound ID wdgtt4Jojl
InChI InChI=1S/C23H39NO6/c1-5-28-21(26)24-11-8-10-23-18(13-16(3)14-20(23)25)15-17(4)19(23)9-7-12-30-22(27)29-6-2/h16,18-20,25H,4-15H2,1-3H3,(H,24,26)
InChIKey FVLRIKRTZTUQQS-UHFFFAOYSA-N
Mol Weight 425.6 g/mol
Molecular Formula C23H39NO6
Exact Mass 425.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bybnt93HEY
Name (1SR,3aSR,5RS,&RS,&ASR)-7a-[3-[(ethoxycarbonyl)-amino]propyl]octahydro-1-[3-[(ethoxycarbonyl)oxy]-propyl]-7-hydroxy-5-methyl-2-methylene-1H-indene
CAS Registry Number 118892-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H39NO6
InChI InChI=1S/C23H39NO6/c1-5-28-21(26)24-11-8-10-23-18(13-16(3)14-20(23)25)15-17(4)19(23)9-7-12-30-22(27)29-6-2/h16,18-20,25H,4-15H2,1-3H3,(H,24,26)
InChIKey FVLRIKRTZTUQQS-UHFFFAOYSA-N
Molecular Weight 425.566 g/mol
SMILES OC1CC(CC2C1(CCCNC(=O)OCC)C(C(C2)=C)CCCOC(=O)OCC)C
SPLASH splash10-0udr-2910000000-c19bf06a17a05c59a331
Source of Spectrum J-54-1559-36
Synonyms 3-(7a-{3-[(ethoxycarbonyl)amino]propyl}-7-hydroxy-5-methyl-2-methyleneoctahydro-1H-inden-1-yl)propyl ethyl carbonate
Wiley ID 1379646