| SpectraBase Spectrum ID |
L1KpaRbdILo |
| Name |
(1aR,4R,7S,7aR,7bR)-7-deuterio-1,1,4,7-tetramethyl-1a,2,3,4,7a,7b-hexahydrocyclopropa[e]azulen-6-one |
| Alternate Name(s) |
(1aR,4R,7S,7aR,7bR)-7-deuterio-1,1,4,7-tetramethyl-1a,2,3,4,7a,7b-hexahydrocycloprop[e]azulen-6-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21DO |
| InChI |
InChI=1S/C15H22O/c1-8-5-6-11-14(15(11,3)4)13-9(2)12(16)7-10(8)13/h7-9,11,13-14H,5-6H2,1-4H3/t8-,9-,11-,13-,14-/m1/s1/i9D |
| InChIKey |
PSQCZMOLUMURKG-HDKJERKISA-N |
| Molecular Weight |
219.346 g/mol |
| SMILES |
[C@@]12(C(C)(C)[C@@]2(CC[C@](C=2[C@]1([C@@](C(=O)C2)(C)[2D])[H])(C)[H])[H])[H] |
| SPLASH |
splash10-004i-0910000000-a2b8f4953da2636b7fa7 |
| Source of Spectrum |
E1-42-1245-4 |
| Wiley ID |
1552672 |
![(1aR,4R,7S,7aR,7bR)-7-deuterio-1,1,4,7-tetramethyl-1a,2,3,4,7a,7b-hexahydrocyclopropa[e]azulen-6-one](/api/spectrum/L1KpaRbdILo/structure.png?h=300&w=458 "(1aR,4R,7S,7aR,7bR)-7-deuterio-1,1,4,7-tetramethyl-1a,2,3,4,7a,7b-hexahydrocyclopropa[e]azulen-6-one")
