CAS Registry Number®

1234692-67-1
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Molecular Formula

C14H19NO4.C6H13N

Cite this Page

.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1234692-67-1 (retrieved 2024-09-11) (CAS RN: 1234692-67-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H19NO4.C6H13N/c1-14(2,3)11(12(16)17)15-13(18)19-9-10-7-5-4-6-8-10;7-6-4-2-1-3-5-6/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17);6H,1-5,7H2/t11-;/m0./s1

InChIKey

InChIKey=RJZAPWBTFPVKPZ-MERQFXBCSA-N

SMILES

C(OC(N[C@H]([C@](C)(C)C)C(O)=O)=O)C1=CC=CC=C1.NC1CCCCC1

Canonical SMILES

O=C(OCC=1C=CC=CC1)NC(C(=O)O)C(C)(C)C.NC1CCCCC1

Other Names for this Substance

  • Cyclohexanaminium (R)-2-(benzyloxycarbonylamino)-3,3-dimethylbutanoate