CID 273569

Alpha-cyperol

Structural Information

Molecular Formula
C15H24O
SMILES
CC1=C2CC(CCC2(CCC1O)C)C(=C)C
InChI
InChI=1S/C15H24O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12,14,16H,1,5-9H2,2-4H3
InChIKey
APWLDLGOYJHNIK-UHFFFAOYSA-N
Compound name
1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

220.18271 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18999 152.8
[M+Na]+ 243.17193 158.4
[M-H]- 219.17543 155.3
[M+NH4]+ 238.21653 174.0
[M+K]+ 259.14587 154.8
[M+H-H2O]+ 203.17997 148.0
[M+HCOO]- 265.18091 167.3
[M+CH3COO]- 279.19656 190.7
[M+Na-2H]- 241.15738 154.4
[M]+ 220.18216 147.5
[M]- 220.18326 147.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe