SpectraBase Spectrum ID |
LqYC6NHnhuJ |
Name |
2H-Pyran-3-acetic acid, 3,6-dihydro-6-(2-oxopropyl)-, (3R-cis)- |
CAS Registry Number |
100837-42-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H14O4 |
InChI |
InChI=1S/C10H14O4/c1-7(11)4-9-3-2-8(6-14-9)5-10(12)13/h2-3,8-9H,4-6H2,1H3,(H,12,13)/t8-,9+/m0/s1 |
InChIKey |
NQPMAYXZFGCHSO-DTWKUNHWSA-N |
Molecular Weight |
198.218 g/mol |
SMILES |
OC(C[C@@]1(C=C[C@](CC(=O)C)(OC1)[H])[H])=O |
SPLASH |
splash10-000i-0900000000-1cd7453fb2ad2f4512a7 |
Source of Spectrum |
J-53-5918-33 |
Synonyms |
[(3R,6S)-6-(2-oxopropyl)-3,6-dihydro-2H-pyran-3-yl]acetic acid
[2(S)-(2-oxopropyl)-5,6-dihydro-2H-pyran-5(R)-yl]acetic acid |
Wiley ID |
1195242 |