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.delta.9-THC Acetate
SpectraBase Compound ID 2RFy9cVma8N
InChI InChI=1S/C23H32O3/c1-6-7-8-9-17-13-20(25-16(3)24)22-18-12-15(2)10-11-19(18)23(4,5)26-21(22)14-17/h12-14,18-19H,6-11H2,1-5H3/t18-,19-/m1/s1
InChIKey DEWSJDIJFWQLOA-RTBURBONSA-N
Mol Weight 356.5 g/mol
Molecular Formula C23H32O3
Exact Mass 356.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8F0eCUY5iL2
Name delta-9-Tetrahydrocannabinol AC
Classification Phytocannabinoid derivative
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 356.235144887 u
Formula C23H32O3
InChI InChI=1S/C23H32O3/c1-6-7-8-9-17-13-20(25-16(3)24)22-18-12-15(2)10-11-19(18)23(4,5)26-21(22)14-17/h12-14,18-19H,6-11H2,1-5H3/t18-,19-/m1/s1
InChIKey DEWSJDIJFWQLOA-RTBURBONSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 356.506 g/mol
Nominal Mass 356 u
Quality 964
Retention Index 2487
SMILES [C@@]12([C@](C3=C(OC2(C)C)C=C(C=C3OC(=O)C)CCCCC)(C=C(CC1)C)[H])[H]
SPLASH splash10-0002-1292000000-255096ec9ddf4e1d84ec
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-yl acetate
Technique GC/MS
Wiley ID DD2024_020173