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Ethyl-N-(3,4,4-trimethyl-1,2-dioxetane-3-ylmethoxycarbonyl)-L-phenylalanate
SpectraBase Compound ID CKifI4Rv2QK
InChI InChI=1S/C18H25NO6/c1-5-22-15(20)14(11-13-9-7-6-8-10-13)19-16(21)23-12-18(4)17(2,3)24-25-18/h6-10,14H,5,11-12H2,1-4H3,(H,19,21)/t14-,18?/m0/s1
InChIKey LLCJXZXMAXKKGC-PIVQAISJSA-N
Mol Weight 351.4 g/mol
Molecular Formula C18H25NO6
Exact Mass 351.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4jU8Vdr495
Name Ethyl-N-(3,4,4-trimethyl-1,2-dioxetane-3-ylmethoxycarbonyl)-L-phenylalanate
CAS Registry Number 109123-77-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO6
InChI InChI=1S/C18H25NO6/c1-5-22-15(20)14(11-13-9-7-6-8-10-13)19-16(21)23-12-18(4)17(2,3)24-25-18/h6-10,14H,5,11-12H2,1-4H3,(H,19,21)/t14-,18?/m0/s1
InChIKey LLCJXZXMAXKKGC-PIVQAISJSA-N
Molecular Weight 351.399 g/mol
SMILES N(C(OCC1(C(C)(C)OO1)C)=O)[C@](C(=O)OCC)(Cc1ccccc1)[H]
SPLASH splash10-0006-9100000000-3d75d68f7c123e157f1a
Source of Spectrum K-120-1570-7
Synonyms Ethyl (2S)-3-phenyl-2-({[(3,4,4-trimethyl-1,2-dioxetan-3-yl)methoxy]carbonyl}amino)propanoate Ethyl-N-(3,4,4-trimethyl-1,2-dioxethane-3-ylmethoxycarbonyl)-L-phenylalanate
Wiley ID 1342556