CID 37163

35515-92-5

Structural Information

Molecular Formula
C16H24N2O
SMILES
CCOC(C1=CC=CC=C1)C(=N)N2CCCCCC2
InChI
InChI=1S/C16H24N2O/c1-2-19-15(14-10-6-5-7-11-14)16(17)18-12-8-3-4-9-13-18/h5-7,10-11,15,17H,2-4,8-9,12-13H2,1H3
InChIKey
KMVPQVNIERFQCX-UHFFFAOYSA-N
Compound name
1-(azepan-1-yl)-2-ethoxy-2-phenylethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.196146 160.7
[M+Na]+ 283.178088 161.0
[M-H]- 259.181594 165.4
[M+NH4]+ 278.222693 174.0
[M+K]+ 299.152028 162.8
[M+H-H2O]+ 243.186130 152.5
[M+HCOO]- 305.187071 177.8
[M+CH3COO]- 319.202721 199.5
[M+Na-2H]- 281.163536 162.6
[M]+ 260.18832142 152.7
[M]- 260.18941858 152.7
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.