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1,3-Cyclopentanediol, mono(phenylcarbamate), trans-(+)-
SpectraBase Compound ID 8VBj1XxqDt
InChI InChI=1S/C12H15NO3/c14-10-6-7-11(8-10)16-12(15)13-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2,(H,13,15)/t10-,11-/m1/s1
InChIKey LLTWAJHCGZRUCE-GHMZBOCLSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GK4oLfHczCi
Name 1,3-Cyclopentanediol, mono(phenylcarbamate), trans-(+)-
Alternate Name(s) (1R,3R)-3-hydroxycyclopentyl phenylcarbamate 3-Hydroxycyclopentyl-N-phenyl carbamate
CAS Registry Number 133826-16-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c14-10-6-7-11(8-10)16-12(15)13-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2,(H,13,15)/t10-,11-/m1/s1
InChIKey LLTWAJHCGZRUCE-GHMZBOCLSA-N
Molecular Weight 221.256 g/mol
SMILES N(C(O[C@]1(C[C@@](CC1)(O)[H])[H])=O)c1ccccc1
SPLASH splash10-00ko-9520000000-18088dd81bfbb19a3a29
Source of Spectrum F-47-1455-11
Wiley ID 1221287