CID 103212
Sandalore
Structural Information
- Molecular Formula
- C14H26O
- SMILES
- CC1=CCC(C1(C)C)CCC(C)C(C)O
- InChI
- InChI=1S/C14H26O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h7,10,12-13,15H,6,8-9H2,1-5H3
- InChIKey
- NGYMOTOXXHCHOC-UHFFFAOYSA-N
- Compound name
- 3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pentan-2-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 211.20564 | 152.8 |
[M+Na]+ | 233.18758 | 158.9 |
[M-H]- | 209.19108 | 154.9 |
[M+NH4]+ | 228.23218 | 175.3 |
[M+K]+ | 249.16152 | 156.8 |
[M+H-H2O]+ | 193.19562 | 148.8 |
[M+HCOO]- | 255.19656 | 171.7 |
[M+CH3COO]- | 269.21221 | 189.8 |
[M+Na-2H]- | 231.17303 | 152.1 |
[M]+ | 210.19781 | 153.1 |
[M]- | 210.19891 | 153.1 |