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(4aRS,7aSR,8SR)-6-Benzyl-7-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-8-carboxylic acid
SpectraBase Compound ID Irh771eyeX5
InChI InChI=1S/C18H17NO4/c20-17-14-13(10-19(17)9-11-4-2-1-3-5-11)8-12-6-7-23-16(12)15(14)18(21)22/h1-7,13-15H,8-10H2,(H,21,22)/t13-,14-,15-/m0/s1
InChIKey MSAIGLZRIZKDBQ-KKUMJFAQSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GMgMjDsryE
Name (4aRS,7aSR,8SR)-6-Benzyl-7-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-8-carboxylic acid
Alternate Name(s) (4aR,7aS,8S)-6-benzyl-7-oxo-4a,5,6,7,7a,8-hexahydro-4H-furo[2,3-f]isoindole-8-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c20-17-14-13(10-19(17)9-11-4-2-1-3-5-11)8-12-6-7-23-16(12)15(14)18(21)22/h1-7,13-15H,8-10H2,(H,21,22)/t13-,14-,15-/m0/s1
InChIKey MSAIGLZRIZKDBQ-KKUMJFAQSA-N
Literature Reference DOI 10.1016/j.tet.2016.03.023
Molecular Weight 311.337 g/mol
SMILES OC([C@@]1(c2occc2C[C@@]2([C@@]1(C(N(C2)Cc1ccccc1)=O)[H])[H])[H])=O
SPLASH splash10-014l-9660000000-e62f1cea6d76c456e456
Source of Spectrum F-72-2252-23.2
Wiley ID 1805916