SpectraBase Compound ID | JQbtnmRezKQ |
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InChI | InChI=1S/C25H33N3O/c29-24(26-25-13-18-10-19(14-25)12-20(11-18)15-25)23-21-8-4-5-9-22(21)28(27-23)16-17-6-2-1-3-7-17/h4-5,8-9,17-20H,1-3,6-7,10-16H2,(H,26,29)/t18-,19+,20-,25- |
InChIKey | ACFKPINHOINOFB-UWIHHVNISA-N |
Mol Weight | 391.6 g/mol |
Molecular Formula | C25H33N3O |
Exact Mass | 391.262363 g/mol |
SpectraBase Spectrum ID | 3IFMLCgKptW |
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Name | ACHMINACA |
Source of Sample | Cayman Chemical Company |
Catalog Number | 25006 |
Lot Number | 0527214-5 |
Accessory | DurasamplIR II |
Acronyms | Adamantyl-CHMINACA |
Apodization Function | Norton-Beer, medium |
CAS Registry Number | 1400742-33-7 |
Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C25H33N3O |
IUPAC Name | 1-(Cyclohexylmethyl)-N-tricyclo[3.3.1.13,7]dec-1-yl-1H-indazole-3-carboxamide |
InChI | InChI=1S/C25H33N3O/c29-24(26-25-13-18-10-19(14-25)12-20(11-18)15-25)23-21-8-4-5-9-22(21)28(27-23)16-17-6-2-1-3-7-17/h4-5,8-9,17-20H,1-3,6-7,10-16H2,(H,26,29)/t18-,19+,20-,25- |
InChIKey | ACFKPINHOINOFB-UWIHHVNISA-N |
Instrument Name | Bio-Rad FTS |
SMILES | N(C(c1c2c([n](n1)CC1CCCCC1)cccc2)=O)[C@]12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H] |
Scan Speed (number) | 5 |
Source of Spectrum | Forensic Spectral Research |
Technique | ATR-Neat |