SpectraBase Spectrum ID |
JHVCc18djVY |
Name |
Leucine |
CAS Registry Number |
61-90-5 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
131.094628661 u |
Formula |
C6H13NO2 |
InChI |
InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1 |
InChIKey |
ROHFNLRQFUQHCH-YFKPBYRVSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
131.175 g/mol |
Nominal Mass |
131 u |
Quality |
959 |
Retention Index |
961 |
SMILES |
OC([C@](CC(C)C)(N)[H])=O |
SPLASH |
splash10-007c-9000000000-dfb9e98f144290ae3376 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(2S)-2-amino-4-methylpentanoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_027572 |