CID 66358177

2,2-diethyl-3-methoxycyclobutan-1-amine

Structural Information

Molecular Formula
C9H19NO
SMILES
CCC1(C(CC1OC)N)CC
InChI
InChI=1S/C9H19NO/c1-4-9(5-2)7(10)6-8(9)11-3/h7-8H,4-6,10H2,1-3H3
InChIKey
ACLMMZWSFWNWEH-UHFFFAOYSA-N
Compound name
2,2-diethyl-3-methoxycyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 137.3
[M+Na]+ 180.135888 143.3
[M-H]- 156.139394 140.7
[M+NH4]+ 175.180493 153.8
[M+K]+ 196.109828 145.4
[M+H-H2O]+ 140.143930 128.3
[M+HCOO]- 202.144871 158.9
[M+CH3COO]- 216.160521 185.5
[M+Na-2H]- 178.121336 141.3
[M]+ 157.14612142 146.0
[M]- 157.14721858 146.0
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.