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N-[(3R,4S)-4-(3,4-dichlorophenyl)-3-pyrrolidinyl]carbamic acid tert-butyl ester
SpectraBase Compound ID GkO9CSuvEHt
InChI InChI=1S/C15H20Cl2N2O2/c1-15(2,3)21-14(20)19-13-8-18-7-10(13)9-4-5-11(16)12(17)6-9/h4-6,10,13,18H,7-8H2,1-3H3,(H,19,20)/t10-,13+/m1/s1
InChIKey YHHAOQKKFBRMQA-MFKMUULPSA-N
Mol Weight 331.24 g/mol
Molecular Formula C15H20Cl2N2O2
Exact Mass 330.090183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwYXYWGkOLH
Name N-[(3R,4S)-4-(3,4-dichlorophenyl)-3-pyrrolidinyl]carbamic acid tert-butyl ester
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Formula C15H20Cl2N2O2
InChI InChI=1S/C15H20Cl2N2O2/c1-15(2,3)21-14(20)19-13-8-18-7-10(13)9-4-5-11(16)12(17)6-9/h4-6,10,13,18H,7-8H2,1-3H3,(H,19,20)/t10-,13+/m1/s1
InChIKey YHHAOQKKFBRMQA-MFKMUULPSA-N
Molecular Weight 331.243 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@]1(CNC[C@@]1(c1cc(Cl)c(cc1)Cl)[H])[H]
SPLASH splash10-003r-0089000000-373debfbf99b7e2545d1
Source of Spectrum E1-36-4146-22
Synonyms N-[(3R,4S)-4-(3,4-dichlorophenyl)pyrrolidin-3-yl]carbamic acid tert-butyl ester tert-Butyl N-[(3R,4S)-4-(3,4-dichlorophenyl)pyrrolidin-3-yl]carbamate
Wiley ID 1574833