| SpectraBase Spectrum ID |
vjG5T8yt8X |
| Name |
(1R,4S,4aR,7E,11E,12aS)-4,12a-dideuterio-1-isopropenyl-4,7,11-trimethyl-1,2,3,4a,5,6,9,10-octahydrobenzo[10]annulene |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.262954522 u |
| Formula |
C20H30D2 |
| GC Oven Program |
Oven temp 280oC |
| InChI |
InChI=1S/C20H32/c1-14(2)18-12-10-17(5)19-11-9-15(3)7-6-8-16(4)13-20(18)19/h7,13,17-20H,1,6,8-12H2,2-5H3/b15-7+,16-13+/t17-,18-,19+,20-/m0/s1/i17D,20D |
| InChIKey |
ANDATAQAGZTPOQ-LFBJZRFYSA-N |
| Instrument Name |
Thermo Trace GC ultra-ISQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202109641 |
| Molecular Weight |
274.488 g/mol |
| Quality |
894 |
| SMILES |
C1[C@]([C@]2([C@@]([C@](C1)(C)[D])(CC\C(=C\CC\C(=C\2)C)C)[H])[D])(C(=C)C)[H] |
| SPLASH |
splash10-08fr-5910000000-2183baaa5790c4dc3284 |
| Source of Spectrum |
ACI-60-SM16-2H2-1 (DOI: 10.1002/anie.202109641) |
| Wiley ID |
1893684 |
![(1R,4S,4aR,7E,11E,12aS)-4,12a-dideuterio-1-isopropenyl-4,7,11-trimethyl-1,2,3,4a,5,6,9,10-octahydrobenzo[10]annulene](/api/spectrum/vjG5T8yt8X/structure.png?h=300&w=458 "(1R,4S,4aR,7E,11E,12aS)-4,12a-dideuterio-1-isopropenyl-4,7,11-trimethyl-1,2,3,4a,5,6,9,10-octahydrobenzo[10]annulene")
