| SpectraBase Spectrum ID |
8d2TFCpMJ88 |
| Name |
3H-3a,6-Methanoazulen-9-one, 2-(bromomethyl)-4,5,6,7,8,8a-hexahydro-5,5-dimethyl-, (3a.alpha.,6.alpha.,8a.alpha.)-(.+-.)- |
| CAS Registry Number |
89116-42-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H19BrO |
| InChI |
InChI=1S/C14H19BrO/c1-13(2)8-14-6-9(7-15)5-10(14)3-4-11(13)12(14)16/h5,10-11H,3-4,6-8H2,1-2H3/t10-,11+,14+/m0/s1 |
| InChIKey |
CNGXBPPRTBXXDT-COPLHBTASA-N |
| Molecular Weight |
283.209 g/mol |
| SMILES |
[C@@]123C([C@]([H])(C(C3)(C)C)CC[C@]1(C=C(C2)CBr)[H])=O |
| SPLASH |
splash10-0udi-0090000000-30c82091ec0e47b74400 |
| Source of Spectrum |
F-39-3242-0 |
| Synonyms |
(1S+,5R+,8R+)-3-Hydroxymethyl-9,9-dimethyl-11-oxotricyclo[6.2.1.0(1,5)]undec-3-enyl bromide
3H-3a,6-Methanoazulen-9-one, 2-(bromomethyl)-4,5,6,7,8,8a-hexahydro-5,5-dimethyl-, (3a.alpha.,6.alpha.,8a.beta.)-(.+-.)-
(1S+,5S+,8R+)-3-Hydroxymethyl-9,9-dimethyl-11-oxotricyclo[6.2.1.0(1,5)]undec-3-enyl bromide
(1S,5S,8R)-3-(bromomethyl)-9,9-dimethyltricyclo[6.2.1.0(1,5)]undec-3-en-11-one
Bromide 21
Bromide of 21 |
| Wiley ID |
1285661 |
