CID 16723410

9-undecenenitrile, (9z)-

Structural Information

Molecular Formula
C11H19N
SMILES
C/C=C\CCCCCCCC#N
InChI
InChI=1S/C11H19N/c1-2-3-4-5-6-7-8-9-10-11-12/h2-3H,4-10H2,1H3/b3-2-
InChIKey
RPLWLQJSZFPHGM-IHWYPQMZSA-N
Compound name
(Z)-undec-9-enenitrile
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

193
Patents

165.15175 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.159026 137.0
[M+Na]+ 188.140968 144.8
[M-H]- 164.144474 137.4
[M+NH4]+ 183.185573 156.1
[M+K]+ 204.114908 142.4
[M+H-H2O]+ 148.149010 125.6
[M+HCOO]- 210.149951 156.3
[M+CH3COO]- 224.165601 194.3
[M+Na-2H]- 186.126416 142.0
[M]+ 165.15120142 134.5
[M]- 165.15229858 134.5
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

patents stripe