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[15-13C]-Dihydro-epi-deoxy-3-hydrperoxyarteannuin B
SpectraBase Compound ID 5OQgaI0eNI
InChI InChI=1S/C15H22O4/c1-8-4-5-11-10(3)14(16)18-15(11)7-9(2)13(19-17)6-12(8)15/h7-8,10-13,17H,4-6H2,1-3H3/t8-,10-,11+,12+,13?,15-/m1/s1/i2+1
InChIKey QIANKIQKWJHWJX-ZEGFQSTOSA-N
Mol Weight 267.33 g/mol
Molecular Formula C1413CH22O4
Exact Mass 267.155164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ms7cXyEEq
Name [15-13C]-Dihydro-epi-deoxy-3-hydrperoxyarteannuin B
Comments Original formula: C14[13C]H22O4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4
InChI InChI=1S/C15H22O4/c1-8-4-5-11-10(3)14(16)18-15(11)7-9(2)13(19-17)6-12(8)15/h7-8,10-13,17H,4-6H2,1-3H3/t8-,10-,11+,12+,13?,15-/m1/s1/i2+1
InChIKey QIANKIQKWJHWJX-ZEGFQSTOSA-N
Molecular Weight 267.329 g/mol
SMILES OOC1C[C@]2([C@@](CC[C@]3([C@](C(O[C@@]23C=C1[13CH3])=O)(C)[H])[H])(C)[H])[H]
SPLASH splash10-01ta-0890000000-df4a24dc16646fcd72e1
Source of Spectrum KC-57-8509-31
Wiley ID 1626089