| SpectraBase Spectrum ID |
9K02mCSJEQY |
| Name |
Pentazocine |
| Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula |
C19H27NO |
| InChI |
InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m1/s1 |
| InChIKey |
VOKSWYLNZZRQPF-CCKFTAQKSA-N |
| SMILES |
Oc1cc2c(cc1)C[C@@]1(N(CC[C@]2([C@@]1(C)[H])C)CC=C(C)C)[H] |
| SPLASH |
splash10-014m-9520000000-64b6d88499608cd181b3 |
| Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |
