CID 155926100

Chebi:173121

Structural Information

Molecular Formula
C15H26O
SMILES
CC1=C[C@H]([C@@H](CC1)[C@H](C)CCC=C(C)C)O
InChI
InChI=1S/C15H26O/c1-11(2)6-5-7-13(4)14-9-8-12(3)10-15(14)16/h6,10,13-16H,5,7-9H2,1-4H3/t13-,14+,15-/m1/s1
InChIKey
ZOYAMQNIYAMHTE-QLFBSQMISA-N
Compound name
(1S,6S)-3-methyl-6-[(2R)-6-methylhept-5-en-2-yl]cyclohex-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.19836 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.205636 156.7
[M+Na]+ 245.187578 160.9
[M-H]- 221.191084 158.0
[M+NH4]+ 240.232183 174.8
[M+K]+ 261.161518 157.9
[M+H-H2O]+ 205.195620 151.2
[M+HCOO]- 267.196561 173.3
[M+CH3COO]- 281.212211 192.1
[M+Na-2H]- 243.173026 155.4
[M]+ 222.19781142 154.2
[M]- 222.19890858 154.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.