CID 5365004

Trans-2-undecen-1-ol

Structural Information

Molecular Formula
C11H22O
SMILES
CCCCCCCC/C=C/CO
InChI
InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h9-10,12H,2-8,11H2,1H3/b10-9+
InChIKey
SKBIQKQBLQHOSU-MDZDMXLPSA-N
Compound name
(E)-undec-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1
References

719
Patents

170.16707 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.174346 144.1
[M+Na]+ 193.156288 149.2
[M-H]- 169.159794 142.2
[M+NH4]+ 188.200893 164.2
[M+K]+ 209.130228 146.7
[M+H-H2O]+ 153.164330 139.2
[M+HCOO]- 215.165271 165.2
[M+CH3COO]- 229.180921 180.1
[M+Na-2H]- 191.141736 148.1
[M]+ 170.16652142 146.1
[M]- 170.16761858 146.1
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