| SpectraBase Spectrum ID |
3XvQ9SABXGD |
| Name |
(5'R,6'S,7'R)-7'-Hydroxymethyl-5'-methylspiro[cyclohexane-1,2'-[3]oxa[1]azabicyclo[4.2.0]octane]-8-one |
| Alternate Name(s) |
(5R,6S,7R)-7-(hydroxymethyl)-5-methyl-8-spiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]one
(5R,6S,7R)-7-(hydroxymethyl)-5-methylspiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]-8-one
(5R,6S,7R)-7-(hydroxymethyl)-5-methyl-spiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]-8-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H21NO3 |
| InChI |
InChI=1S/C13H21NO3/c1-9-8-17-13(5-3-2-4-6-13)14-11(9)10(7-15)12(14)16/h9-11,15H,2-8H2,1H3/t9-,10-,11-/m0/s1 |
| InChIKey |
RKTMTQDBXITCJD-DCAQKATOSA-N |
| Molecular Weight |
239.315 g/mol |
| SMILES |
OC[C@]1([C@]2(N(C1=O)C1(OC[C@@]2(C)[H])CCCCC1)[H])[H] |
| SPLASH |
splash10-0002-0920000000-257852718b53e7a0c720 |
| Source of Spectrum |
H1-52-882-16 |
| Wiley ID |
817655 |
![(5'R,6'S,7'R)-7'-Hydroxymethyl-5'-methylspiro[cyclohexane-1,2'-[3]oxa[1]azabicyclo[4.2.0]octane]-8-one](/api/spectrum/3XvQ9SABXGD/structure.png?h=300&w=458 "(5'R,6'S,7'R)-7'-Hydroxymethyl-5'-methylspiro[cyclohexane-1,2'-[3]oxa[1]azabicyclo[4.2.0]octane]-8-one")
