CID 28818869

N-cyclopropyl-4-[(cyclopropylamino)methyl]benzamide

Structural Information

Molecular Formula
C14H18N2O
SMILES
C1CC1NCC2=CC=C(C=C2)C(=O)NC3CC3
InChI
InChI=1S/C14H18N2O/c17-14(16-13-7-8-13)11-3-1-10(2-4-11)9-15-12-5-6-12/h1-4,12-13,15H,5-9H2,(H,16,17)
InChIKey
YHORWKMCXKFICF-UHFFFAOYSA-N
Compound name
N-cyclopropyl-4-[(cyclopropylamino)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.149176 151.9
[M+Na]+ 253.131118 157.5
[M-H]- 229.134624 161.1
[M+NH4]+ 248.175723 158.3
[M+K]+ 269.105058 154.6
[M+H-H2O]+ 213.139160 145.5
[M+HCOO]- 275.140101 174.2
[M+CH3COO]- 289.155751 205.9
[M+Na-2H]- 251.116566 155.7
[M]+ 230.14135142 154.0
[M]- 230.14244858 154.0
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.