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(+-)-N-Benzyl-(3S,4R,5R)-3,4-(cyclohexylidenedioxy)-5-acetoxy-2-pyrrolidinone
SpectraBase Compound ID 39Y3WvPNnoE
InChI InChI=1S/C19H23NO5/c1-13(21)23-18-16-15(24-19(25-16)10-6-3-7-11-19)17(22)20(18)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-16,18H,3,6-7,10-12H2,1H3/t15-,16+,18+/m0/s1
InChIKey HSMZBTUXYJJZQX-LZLYRXPVSA-N
Mol Weight 345.4 g/mol
Molecular Formula C19H23NO5
Exact Mass 345.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0SC3ORoqdQ
Name (+-)-N-Benzyl-(3S,4R,5R)-3,4-(cyclohexylidenedioxy)-5-acetoxy-2-pyrrolidinone
Alternate Name(s) (3aS,6R,6aR)-5-benzyl-4-oxo-tetrahydro-3aH-spiro[[1,3]dioxolo[4,5-c]pyrrole-2,1'-cyclohexane]-6-yl acetate
CAS Registry Number 129445-53-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO5
InChI InChI=1S/C19H23NO5/c1-13(21)23-18-16-15(24-19(25-16)10-6-3-7-11-19)17(22)20(18)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-16,18H,3,6-7,10-12H2,1H3/t15-,16+,18+/m0/s1
InChIKey HSMZBTUXYJJZQX-LZLYRXPVSA-N
Molecular Weight 345.395 g/mol
SMILES [C@]1(N(C([C@]2(OC3(O[C@@]12[H])CCCCC3)[H])=O)Cc1ccccc1)(OC(=O)C)[H]
SPLASH splash10-0f6x-9008000000-09bc9754b4fb57a9f354
Source of Spectrum C-112-8106-10
Wiley ID 1338685