CID 3056077

73416-74-7

Structural Information

Molecular Formula
C15H22N2
SMILES
CC1=CC=C(C=C1)C(=NC)NC2CCCCC2
InChI
InChI=1S/C15H22N2/c1-12-8-10-13(11-9-12)15(16-2)17-14-6-4-3-5-7-14/h8-11,14H,3-7H2,1-2H3,(H,16,17)
InChIKey
QQBBXOYKPYYQDA-UHFFFAOYSA-N
Compound name
N-cyclohexyl-N',4-dimethylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1783 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.18558 155.3
[M+Na]+ 253.16752 158.2
[M-H]- 229.17102 162.1
[M+NH4]+ 248.21212 173.0
[M+K]+ 269.14146 155.4
[M+H-H2O]+ 213.17556 147.3
[M+HCOO]- 275.17650 177.8
[M+CH3COO]- 289.19215 198.2
[M+Na-2H]- 251.15297 159.1
[M]+ 230.17775 149.8
[M]- 230.17885 149.8
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.