CID 28386837

2052306-15-5

Structural Information

Molecular Formula
C9H18N2O
SMILES
CN(CCCN)C(=O)C1CCC1
InChI
InChI=1S/C9H18N2O/c1-11(7-3-6-10)9(12)8-4-2-5-8/h8H,2-7,10H2,1H3
InChIKey
GBRIYBSKTHYJJE-UHFFFAOYSA-N
Compound name
N-(3-aminopropyl)-N-methylcyclobutanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

170.1419 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 144.0
[M+Na]+ 193.131118 146.3
[M-H]- 169.134624 147.5
[M+NH4]+ 188.175723 157.2
[M+K]+ 209.105058 149.7
[M+H-H2O]+ 153.139160 131.7
[M+HCOO]- 215.140101 166.0
[M+CH3COO]- 229.155751 191.1
[M+Na-2H]- 191.116566 145.9
[M]+ 170.14135142 150.4
[M]- 170.14244858 150.4
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

patents stripe