SpectraBase Spectrum ID |
3YQPJNhEO0 |
Name |
3a,4-trans-3a,9a-cis-4-(Nitromethyl)-2,3,3a,9a-tetrahydro-4H-furo[2,3-b]chromene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO4 |
InChI |
InChI=1S/C12H13NO4/c14-13(15)7-10-8-3-1-2-4-11(8)17-12-9(10)5-6-16-12/h1-4,9-10,12H,5-7H2/t9-,10+,12+/m1/s1 |
InChIKey |
DXFACLHAKRQVBJ-SCVCMEIPSA-N |
Molecular Weight |
235.239 g/mol |
SMILES |
[C@]1(c2c(cccc2)O[C@]2([C@@]1(CCO2)[H])[H])(CN(=O)=O)[H] |
SPLASH |
splash10-08gl-2900000000-5b90b93ff2c8d995c3cb |
Source of Spectrum |
F-67-7243-19 |
Synonyms |
(3aR,4R,9aS)-4-(nitromethyl)-3,3a,4,9a-tetrahydro-2H-furo[2,3-b][1]benzopyran |
Wiley ID |
1570996 |