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Isopropyl pyroglutamate
SpectraBase Compound ID JrUt0RBtPZ
InChI InChI=1S/C8H13NO3/c1-5(2)12-8(11)6-3-4-7(10)9-6/h5-6H,3-4H2,1-2H3,(H,9,10)/t6-/m0/s1
InChIKey IZHXNBPKBCUDOZ-LURJTMIESA-N
Mol Weight 171.2 g/mol
Molecular Formula C8H13NO3
Exact Mass 171.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3pRz3a6Gqp
Name Isopropyl pyroglutamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO3
InChI InChI=1S/C8H13NO3/c1-5(2)12-8(11)6-3-4-7(10)9-6/h5-6H,3-4H2,1-2H3,(H,9,10)/t6-/m0/s1
InChIKey IZHXNBPKBCUDOZ-LURJTMIESA-N
Instrument Name Agilent 6890-5973
Ionization Type EI
Literature Reference DOI 10.1002/cctc.201900800
Molecular Weight 171.196 g/mol
SMILES N1C(CC[C@]1(C(OC(C)C)=O)[H])=O
SPLASH splash10-001i-9000000000-43d2829786436998265f
Source of Spectrum CCC-11-SM12-5
Wiley ID 1836767