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English
(S)-tert-Butyl azepan-3-ylcarbamate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
214.168127944
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
tert-Butyl (3R)-azepan-3-ylcarbamate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₂₂N₂O₂
0 references
canonical SMILES
CC(C)(C)OC(=O)NC1CCCCNC1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)(C)OC(=O)N[C@H]1CCCCNC1
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Identifiers
InChI
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-6-4-5-7-12-8-9/h9,12H,4-8H2,1-3H3,(H,13,14)/t9-/m0/s1
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InChIKey
NZEPWAXJSWYEDV-VIFPVBQESA-N
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CAS Registry Number
213990-48-8
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PubChem CID
10822534
1 reference
matched by identifier from
InChIKey
InChIKey
NZEPWAXJSWYEDV-VIFPVBQESA-N
UniChem compound ID
26063140
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10445382
1 reference
matched by identifier from
InChIKey
InChIKey
NZEPWAXJSWYEDV-VIFPVBQESA-N
DSSTOX compound identifier
DTXCID50396203
0 references
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