CID 11970593

Ns00126274

Structural Information

Molecular Formula
C12H22N2
SMILES
C1CCC(=CC1)CNCC2CCCN2
InChI
InChI=1S/C12H22N2/c1-2-5-11(6-3-1)9-13-10-12-7-4-8-14-12/h5,12-14H,1-4,6-10H2
InChIKey
WEYQWUQFUYGMOF-UHFFFAOYSA-N
Compound name
N-(cyclohexen-1-ylmethyl)-1-pyrrolidin-2-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1783 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.185576 147.0
[M+Na]+ 217.167518 148.8
[M-H]- 193.171024 149.1
[M+NH4]+ 212.212123 165.0
[M+K]+ 233.141458 145.4
[M+H-H2O]+ 177.175560 139.0
[M+HCOO]- 239.176501 165.2
[M+CH3COO]- 253.192151 182.3
[M+Na-2H]- 215.152966 149.4
[M]+ 194.17775142 138.2
[M]- 194.17884858 138.2
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

No patent data available for this compound.