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(R/s)-3-Heptanol, 2-(s)-[(tert.butyloxycarbonyl)amino]-1-phenyl-
SpectraBase Compound ID 2fAj9tltlvG
InChI InChI=1S/C18H29NO3/c1-5-6-12-16(20)15(13-14-10-8-7-9-11-14)19-17(21)22-18(2,3)4/h7-11,15-16,20H,5-6,12-13H2,1-4H3,(H,19,21)
InChIKey CTCFODBCPLDNNJ-UHFFFAOYSA-N
Mol Weight 307.43 g/mol
Molecular Formula C18H29NO3
Exact Mass 307.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Awx7yoH86DS
Name (R/s)-3-Heptanol, 2-(s)-[(tert.butyloxycarbonyl)amino]-1-phenyl-
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Formula C18H29NO3
InChI InChI=1S/C18H29NO3/c1-5-6-12-16(20)15(13-14-10-8-7-9-11-14)19-17(21)22-18(2,3)4/h7-11,15-16,20H,5-6,12-13H2,1-4H3,(H,19,21)
InChIKey CTCFODBCPLDNNJ-UHFFFAOYSA-N
Molecular Weight 307.434 g/mol
SMILES OC(C(NC(OC(C)(C)C)=O)Cc1ccccc1)CCCC
SPLASH splash10-0ckc-9700000000-7626c1aea1faeb251236
Synonyms N-(1-benzyl-2-hydroxy-hexyl)carbamic acid tert-butyl ester N-(3-hydroxy-1-phenylheptan-2-yl)carbamic acid tert-butyl ester tert-Butyl 1-benzyl-2-hydroxyhexylcarbamate tert-Butyl N-(1-benzyl-2-hydroxy-hexyl)carbamate tert-Butyl N-(3-hydroxy-1-phenylheptan-2-yl)carbamate tert-Butyl N-(3-oxidanyl-1-phenyl-heptan-2-yl)carbamate
Wiley ID 1491509