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(1S,3R,4R)-3-Hydroxymethyl-2-azabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester
SpectraBase Compound ID KCVXzm1a2Vi
InChI InChI=1S/C12H21NO3/c1-12(2,3)16-11(15)13-9-5-4-8(6-9)10(13)7-14/h8-10,14H,4-7H2,1-3H3/t8-,9+,10+/m1/s1
InChIKey RWSFXMOBGKTOCH-UTLUCORTSA-N
Mol Weight 227.3 g/mol
Molecular Formula C12H21NO3
Exact Mass 227.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5970EopzhIM
Name (1S,3R,4R)-3-Hydroxymethyl-2-azabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO3
InChI InChI=1S/C12H21NO3/c1-12(2,3)16-11(15)13-9-5-4-8(6-9)10(13)7-14/h8-10,14H,4-7H2,1-3H3/t8-,9+,10+/m1/s1
InChIKey RWSFXMOBGKTOCH-UTLUCORTSA-N
Literature Reference DOI 10.1002/adsc.200303238
Molecular Weight 227.304 g/mol
SMILES OC[C@@]1(N([C@]2(CC[C@@]1(C2)[H])[H])C(OC(C)(C)C)=O)[H]
SPLASH splash10-0006-3900000000-53eee01e3624f5f99eeb
Source of Spectrum ASC-346-551-4
Synonyms (1S,3R,4R)-tert-butyl 3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate (1R,2R,4S)-2-(hydroxymethyl)-3-azabicyclo[2.2.1]heptane-3-carboxylic acid tert-butyl ester tert-Butyl (1R,2R,4S)-2-(hydroxymethyl)-3-azabicyclo[2.2.1]heptane-3-carboxylate
Wiley ID 1767599