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Norephedrine iBCF
SpectraBase Compound ID Jt2GhV2CCVd
InChI InChI=1S/C14H21NO3/c1-10(2)9-18-14(17)15-11(3)13(16)12-7-5-4-6-8-12/h4-8,10-11,13,16H,9H2,1-3H3,(H,15,17)/t11-,13+/m1/s1
InChIKey MEDYJYAWLSATNT-YPMHNXCESA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Vu8R3gtDhQ
Name Norephedrine iBCF
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 251.152143537 u
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-10(2)9-18-14(17)15-11(3)13(16)12-7-5-4-6-8-12/h4-8,10-11,13,16H,9H2,1-3H3,(H,15,17)/t11-,13+/m1/s1
InChIKey MEDYJYAWLSATNT-YPMHNXCESA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 251.326 g/mol
Nominal Mass 251 u
Quality 951
Retention Index 2233
SMILES O[C@@]([C@](NC(OCC(C)C)=O)(C)[H])(C1=CC=CC=C1)[H]
SPLASH splash10-054o-5910000000-d986631a1b348b670846
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-methylpropyl ((1R,2R)-1-hydroxy-1-phenylpropan-2-yl)carbamate
Technique GC/MS
Wiley ID DD2024_003308