CID 157010029

(-)-trans-isomenth-5-en-2-ol

Structural Information

Molecular Formula
C10H18O
SMILES
C[C@H]1C=C[C@@H](C[C@@H]1O)C(C)C
InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-5,7-11H,6H2,1-3H3/t8-,9-,10-/m0/s1
InChIKey
HHDDWVZSUIVNQG-GUBZILKMSA-N
Compound name
(1S,2S,5S)-2-methyl-5-propan-2-ylcyclohex-3-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.13577 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 135.0
[M+Na]+ 177.12499 141.1
[M-H]- 153.12849 137.1
[M+NH4]+ 172.16959 155.9
[M+K]+ 193.09893 139.6
[M+H-H2O]+ 137.13303 130.2
[M+HCOO]- 199.13397 154.0
[M+CH3COO]- 213.14962 177.6
[M+Na-2H]- 175.11044 137.6
[M]+ 154.13522 132.1
[M]- 154.13632 132.1
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.