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rel-(3R,5S)-2-(tert-Butoxycarbonyl)-5-(chloromethyl)-3-pyrazolidinecarboxylic acid methyl ester
SpectraBase Compound ID 2IKJNVeCO8d
InChI InChI=1S/C11H19ClN2O4/c1-11(2,3)18-10(16)14-8(9(15)17-4)5-7(6-12)13-14/h7-8,13H,5-6H2,1-4H3/t7-,8-/m0/s1
InChIKey DGPPOSQWQLVKQR-YUMQZZPRSA-N
Mol Weight 278.74 g/mol
Molecular Formula C11H19ClN2O4
Exact Mass 278.103335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1V8UsBPzW3k
Name rel-(3R,5S)-2-(tert-Butoxycarbonyl)-5-(chloromethyl)-3-pyrazolidinecarboxylic acid methyl ester
Alternate Name(s) 1-tert-Butyl 5-methyl (3S,5R)-3-(chloromethyl)-1,5-pyrazolidinedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19ClN2O4
InChI InChI=1S/C11H19ClN2O4/c1-11(2,3)18-10(16)14-8(9(15)17-4)5-7(6-12)13-14/h7-8,13H,5-6H2,1-4H3/t7-,8-/m0/s1
InChIKey DGPPOSQWQLVKQR-YUMQZZPRSA-N
Molecular Weight 278.736 g/mol
SMILES N1[C@@](C[C@](N1C(OC(C)(C)C)=O)(C(=O)OC)[H])(CCl)[H]
SPLASH splash10-016u-9800000000-47cc4e1da1b30381eb59
Source of Spectrum F-49-8624-66
Wiley ID 788293