CID 15656059

111722-61-3

Structural Information

Molecular Formula
C7H13N
SMILES
CN1CCCC(=C)C1
InChI
InChI=1S/C7H13N/c1-7-4-3-5-8(2)6-7/h1,3-6H2,2H3
InChIKey
OUKGYFNHAKOXRQ-UHFFFAOYSA-N
Compound name
1-methyl-3-methylidenepiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

111.1048 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.112076 123.1
[M+Na]+ 134.094018 129.5
[M-H]- 110.097524 124.9
[M+NH4]+ 129.138623 144.7
[M+K]+ 150.067958 128.3
[M+H-H2O]+ 94.102060 117.4
[M+HCOO]- 156.103001 142.9
[M+CH3COO]- 170.118651 169.3
[M+Na-2H]- 132.079466 128.8
[M]+ 111.10425142 118.2
[M]- 111.10534858 118.2
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

patents stripe