| SpectraBase Spectrum ID |
Ig32M5rwS3w |
| Name |
(5aR,6s)-4-Hydroxy-6-methyl-5aH-benzo[5,6][1,3]oxazino[3,2-a]indol-12(6H)one |
| Appearance |
Colorless powder |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.089543280 u |
| Formula |
C16H13NO3 |
| InChI |
InChI=1S/C16H13NO3/c1-9-10-5-2-3-7-12(10)17-15(19)11-6-4-8-13(18)14(11)20-16(9)17/h2-9,16,18H,1H3/t9-,16+/m0/s1 |
| InChIKey |
HWUMTQDVUOOAAJ-XXFAHNHDSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/ejoc.201701630 |
| Molecular Weight |
267.284 g/mol |
| Quality |
53 |
| Reported Formula |
C16H13NO3 |
| SMILES |
OC=1C=2O[C@]3(N(C4=C(C=CC=C4)[C@@]3(C)[H])C(C2C=CC1)=O)[H] |
| SPLASH |
splash10-001i-0920000000-6e9cf4520bd09aff95a6 |
| Sample Comments |
dr = 5.9:1 (trans/cis) |
| Source of Spectrum |
K1-2018-906-4d (DOI: 10.1002/ejoc.201701630) |
| Thin-Layer Chromatography |
0.14 (chloroform) |
| Wiley ID |
1894453 |
![(5aR,6s)-4-Hydroxy-6-methyl-5aH-benzo[5,6][1,3]oxazino[3,2-a]indol-12(6H)one](/api/spectrum/Ig32M5rwS3w/structure.png?h=300&w=458 "(5aR,6s)-4-Hydroxy-6-methyl-5aH-benzo[5,6][1,3]oxazino[3,2-a]indol-12(6H)one")
