CID 89283

20172-42-3

Structural Information

Molecular Formula
C19H31N
SMILES
CCCCCCCCCCCCN=CC1=CC=CC=C1
InChI
InChI=1S/C19H31N/c1-2-3-4-5-6-7-8-9-10-14-17-20-18-19-15-12-11-13-16-19/h11-13,15-16,18H,2-10,14,17H2,1H3
InChIKey
RRDJYGJOZRFVNY-UHFFFAOYSA-N
Compound name
N-dodecyl-1-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

273.24564 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.252916 172.2
[M+Na]+ 296.234858 175.2
[M-H]- 272.238364 175.1
[M+NH4]+ 291.279463 188.8
[M+K]+ 312.208798 171.0
[M+H-H2O]+ 256.242900 164.0
[M+HCOO]- 318.243841 196.1
[M+CH3COO]- 332.259491 207.7
[M+Na-2H]- 294.220306 175.7
[M]+ 273.24509142 176.1
[M]- 273.24618858 176.1
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