CID 5283283

7-methyl-6e-nonen-3-ol

Structural Information

Molecular Formula
C10H20O
SMILES
CCC(CC/C=C(\C)/CC)O
InChI
InChI=1S/C10H20O/c1-4-9(3)7-6-8-10(11)5-2/h7,10-11H,4-6,8H2,1-3H3/b9-7+
InChIKey
YVNCFSXFUCUCOE-VQHVLOKHSA-N
Compound name
(E)-7-methylnon-6-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

156.15141 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.15869 140.5
[M+Na]+ 179.14063 145.6
[M-H]- 155.14413 138.9
[M+NH4]+ 174.18523 161.0
[M+K]+ 195.11457 144.2
[M+H-H2O]+ 139.14867 135.9
[M+HCOO]- 201.14961 159.9
[M+CH3COO]- 215.16526 178.7
[M+Na-2H]- 177.12608 142.4
[M]+ 156.15086 140.7
[M]- 156.15196 140.7
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