| SpectraBase Spectrum ID |
3TGvsjG5o |
| Name |
(1R,2R)-1-Methanol-2-acetonitrile-4-cyclohexene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H13NO |
| InChI |
InChI=1S/C9H13NO/c10-6-5-8-3-1-2-4-9(8)7-11/h1-2,8-9,11H,3-5,7H2/t8-,9+/m1/s1 |
| InChIKey |
JOUQTXIXNYKCSG-BDAKNGLRSA-N |
| Molecular Weight |
151.209 g/mol |
| SMILES |
OC[C@]1([C@@](CC#N)(CC=CC1)[H])[H] |
| SPLASH |
splash10-001i-0900000000-5738644591990abee4ef |
| Source of Spectrum |
QC-1-798-12 |
| Synonyms |
2-[(1R,6R)-6-(hydroxymethyl)-1-cyclohex-3-enyl]acetonitrile
2-[(1R,6R)-6-(hydroxymethyl)cyclohex-3-en-1-yl]acetonitrile
2-[(1R,6R)-6-(hydroxymethyl)cyclohex-3-en-1-yl]ethanenitrile |
| Wiley ID |
882875 |
