CID 79002420

1-(aminomethyl)-n-methylcyclobutan-1-amine

Structural Information

Molecular Formula
C6H14N2
SMILES
CNC1(CCC1)CN
InChI
InChI=1S/C6H14N2/c1-8-6(5-7)3-2-4-6/h8H,2-5,7H2,1H3
InChIKey
QQNQTARUSRGFQV-UHFFFAOYSA-N
Compound name
1-(aminomethyl)-N-methylcyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

114.1157 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.12298 126.3
[M+Na]+ 137.10492 130.8
[M-H]- 113.10842 129.4
[M+NH4]+ 132.14952 143.4
[M+K]+ 153.07886 133.2
[M+H-H2O]+ 97.112960 116.6
[M+HCOO]- 159.11390 149.5
[M+CH3COO]- 173.12955 177.2
[M+Na-2H]- 135.09037 133.2
[M]+ 114.11515 131.0
[M]- 114.11625 131.0
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

patents stripe