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12-hydroxy-2,2-dimethyl-13-heptadecynoic acid
SpectraBase Compound ID 8rDCCU4SYhh
InChI InChI=1S/C19H34O3/c1-4-5-11-14-17(20)15-12-9-7-6-8-10-13-16-19(2,3)18(21)22/h17,20H,4-10,12-13,15-16H2,1-3H3,(H,21,22)
InChIKey SRFRXQFUBHGMIN-UHFFFAOYSA-N
Mol Weight 310.5 g/mol
Molecular Formula C19H34O3
Exact Mass 310.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Vy0QzF9DCe
Name 12-hydroxy-2,2-dimethyl-13-heptadecynoic acid
Alternate Name(s) 12-hydroxy-2,2-dimethyl-heptadec-13-ynoic acid 2,2-Dimethyl-12-oxidanyl-heptadec-13-ynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H34O3
InChI InChI=1S/C19H34O3/c1-4-5-11-14-17(20)15-12-9-7-6-8-10-13-16-19(2,3)18(21)22/h17,20H,4-10,12-13,15-16H2,1-3H3,(H,21,22)
InChIKey SRFRXQFUBHGMIN-UHFFFAOYSA-N
Molecular Weight 310.478 g/mol
SMILES OC(CCCCCCCCCC(C(=O)O)(C)C)C#CCCC
SPLASH splash10-0006-9030000000-b3e85d110a0fc5ce97c9
Source of Spectrum E1-36-1422-15
Wiley ID 1574676