Debug Info

object
{15}
_id
:
52oFSy7WhZ1
spectrumID
:
52oFSy7WhZ1
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:509574:1
hasStructureAssignments
:
false
properties
{11}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
:
Mass Spectrum (GC)
isFullSpectrum
:
false
spectralOutlier
:
false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
Dimethyl 2-methyl-c-5-[1'-(1"-methoxycarbonyl-2"-oxocycloheptyl)ethyl]pyrrolidine-s-2,c-4-dicarboxylate
SpectraBase Compound ID A71Iou6k7JW
InChI InChI=1S/C20H31NO7/c1-19(17(24)27-3)12-13(16(23)26-2)14(21-19)9-11-20(18(25)28-4)10-7-5-6-8-15(20)22/h13-14,21H,5-12H2,1-4H3/t13-,14-,19-,20?/m0/s1
InChIKey UWMNRKFWODJHEH-NRFVGKODSA-N
Mol Weight 397.47 g/mol
Molecular Formula C20H31NO7
Exact Mass 397.210052 g/mol
ADVERTISEMENT

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 52oFSy7WhZ1
Name Dimethyl 2-methyl-c-5-[1'-(1"-methoxycarbonyl-2"-oxocycloheptyl)ethyl]pyrrolidine-s-2,c-4-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO7
InChI InChI=1S/C20H31NO7/c1-19(17(24)27-3)12-13(16(23)26-2)14(21-19)9-11-20(18(25)28-4)10-7-5-6-8-15(20)22/h13-14,21H,5-12H2,1-4H3/t13-,14-,19-,20?/m0/s1
InChIKey UWMNRKFWODJHEH-NRFVGKODSA-N
Molecular Weight 397.468 g/mol
SMILES N1[C@]([C@](C[C@]1(C(=O)OC)C)(C(=O)OC)[H])(CCC1(C(=O)OC)C(=O)CCCCC1)[H]
SPLASH splash10-000i-5139000000-2afb4dd975cfd64a3e26
Source of Spectrum F-55-1773-12
Synonyms (2S,4S,5S)-Dimethyl 2-methyl-5-[2'-(1''-methoxycarbonyl-2''-oxocycloheptyl)ethyl]pyrrolidine-2,4-dicarboxylate Dimethyl (2S,4S,5S)-5-{(1R)-1-[1-(methoxycarbonyl)-2-oxocycloheptyl]ethyl}-2-methyl-2,4-pyrrolidinedicarboxylate Dimethyl 2-methyl-c-5-[1'-(1''-methoxycarbonyl-2''-oxocycloheptyl)ethyl]pyrrolidine-r-2,c-4-dicarboxylate
Wiley ID 836719
ADVERTISEMENT