CID 15984303

107898-54-4

Structural Information

Molecular Formula
C15H26O
SMILES
CC1=CCC(C1(C)C)/C=C/C(C)(C)C(C)O
InChI
InChI=1S/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3/b10-9+
InChIKey
QZFSNJAQFWEXEA-MDZDMXLPSA-N
Compound name
(E)-3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1205
Patents

222.19836 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.20564 156.0
[M+Na]+ 245.18758 165.1
[M+NH4]+ 240.23218 164.9
[M+K]+ 261.16152 159.6
[M-H]- 221.19108 156.1
[M+Na-2H]- 243.17303 160.1
[M]+ 222.19781 157.4
[M]- 222.19891 157.4
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